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Also known as: 106649-96-1, 8535iq0676, [2-(diaminomethylideneamino)-1,3-thiazol-4-yl]methyl carbamimidothioate, Carbamimidothioic acid, (2-((aminoiminomethyl)amino)-4-thiazolyl)methyl ester, (2-((diaminomethylene)amino)thiazol-4-yl)methyl carbamimidothioate, Famotidine impurity h [ep]
Molecular Formula
C6H10N6S2
Molecular Weight
230.3  g/mol
InChI Key
QUBHCMPAOWIZMT-UHFFFAOYSA-N
FDA UNII
8535IQ0676

CAS 106649-96-1
1 2D Structure

CAS 106649-96-1

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
[2-(diaminomethylideneamino)-1,3-thiazol-4-yl]methyl carbamimidothioate
2.1.2 InChI
InChI=1S/C6H10N6S2/c7-4(8)12-6-11-3(2-14-6)1-13-5(9)10/h2H,1H2,(H3,9,10)(H4,7,8,11,12)
2.1.3 InChI Key
QUBHCMPAOWIZMT-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=C(N=C(S1)N=C(N)N)CSC(=N)N
2.2 Other Identifiers
2.2.1 UNII
8535IQ0676
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 106649-96-1

2. 8535iq0676

3. [2-(diaminomethylideneamino)-1,3-thiazol-4-yl]methyl Carbamimidothioate

4. Carbamimidothioic Acid, (2-((aminoiminomethyl)amino)-4-thiazolyl)methyl Ester

5. (2-((diaminomethylene)amino)thiazol-4-yl)methyl Carbamimidothioate

6. Famotidine Impurity H [ep]

7. Unii-8535iq0676

8. Starbld0008947

9. Schembl1903834

10. Schembl10782626

11. Dtxsid50147717

12. Zinc2241666

13. Famotidine Impurity H [ep Impurity]

14. S-[(2-guanidino-4-thiazolyl)methyl]isothiourea

15. S-[(2-guanidino-thiazol-4-yl)methyl]isothiourea

16. Q27269585

2.4 Create Date
2005-07-13
3 Chemical and Physical Properties
Molecular Weight 230.3 g/mol
Molecular Formula C6H10N6S2
XLogP30.6
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass230.04083669 g/mol
Monoisotopic Mass230.04083669 g/mol
Topological Polar Surface Area181 Ų
Heavy Atom Count14
Formal Charge0
Complexity239
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

BUILDING BLOCK

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01

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2024 ACI Convention
Not Confirmed
  • fda
  • EDQM
  • WHO-GMP

Virtual BoothFaran Shimi: Leading producer of high-quality APIs & alkaloid opiates, serving major pharmaceutical companies across the Middle East.

(2-((Diaminomethylidene)amino)thiazol-4-yl)methyl ...

CAS Number : 88046-01-9

End Use API :

About the Company : Faran Shimi Pharmaceutical Company, established in 2001 and affiliated with Golrang Pharmaceutical Investment Co, manufactures high-quality Active Pharmaceutical Ingredients (APIs) and ...

Faran Shimi Pharmaceutical

02

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2024 ACI Convention
Not Confirmed

S-2[2-Guanidino-4-thiaolyl)methylisothiourea DI HC...

CAS Number : 106649-95-0

End Use API :

About the Company : Dorrapharma is engaged in R&D, manufacture and market of intermediate, API (Active Pharmaceutical Ingredients) and formulation. We stick to raise the value both for the company and cust...

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03

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2024 ACI Convention
Not Confirmed

N-4-AMINOIMINOMETHYL-THIOMETHY-2-THIZOLYL GUANIDI...

CAS Number : 88046-01-9

End Use API :

About the Company : The proverb-a sound mind in a sound body can aptly be termed in conjunction with making of the society healthy, with the idea of providing complete health to mankind, is the aim behind ...

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04

2024 ACI Convention
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Pluviaendo

Turkey
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2024 ACI Convention
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[2-[(Diaminomethylidene)amino]thiazol-4-yl]methyl ...

CAS Number : 88046-01-9

End Use API :

About the Company : Pluvia Consumer Health is a multinational pharmaceutical company with its head office in Turkey/Istanbul & with unique molecules & know-how. Our portfolio contains several specific APIs...

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05

2024 ACI Convention
Not Confirmed
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2024 ACI Convention
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ISO THIOUREA [(S)-((2-GUANIDINO-4-THIAZOLYL) METH...

CAS Number : 88046-01-9

End Use API :

About the Company : Riddhi Pharma was set up in 1997 as a Manufacturer of API’s Intermediates and Fine Chemicals, especially in the field of Friedel Crafts Reaction / Bromination and Chlorination. The es...

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06

2024 ACI Convention
Not Confirmed
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2024 ACI Convention
Not Confirmed

N-[4-[[(amino iminomethyl) thio]-methyl]-2-thiazol...

CAS Number : 88046-01-9

End Use API :

About the Company : SMS Lifesciences is a global player in APIs/Intermediates manufacturing having a strong research and manufacturing team supported by state of the art facilities. What started off as a s...

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