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CAS 106649-95-0
Also known as: 106492-70-0, N-sulphamyl-3-chloropropioamidine, 3-chloro-n'-sulfamoylpropanimidamide, Schembl17726960, Akos006294949, Akos024367245
Molecular Formula
C3H8ClN3O2S
Molecular Weight
185.63  g/mol
InChI Key
QZFCNUHDVLMXDA-UHFFFAOYSA-N

1 2D Structure

CAS 106649-95-0

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
3-chloro-N'-sulfamoylpropanimidamide
2.1.2 InChI
InChI=1S/C3H8ClN3O2S/c4-2-1-3(5)7-10(6,8)9/h1-2H2,(H2,5,7)(H2,6,8,9)
2.1.3 InChI Key
QZFCNUHDVLMXDA-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C(CCl)C(=NS(=O)(=O)N)N
2.1.5 Isomeric SMILES
C(CCl)/C(=N/S(=O)(=O)N)/N
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 106492-70-0

2. N-sulphamyl-3-chloropropioamidine

3. 3-chloro-n'-sulfamoylpropanimidamide

4. Schembl17726960

5. Akos006294949

6. Akos024367245

7. 92c700

8. A911256

2.3 Create Date
2005-07-19
3 Chemical and Physical Properties
Molecular Weight 185.63 g/mol
Molecular Formula C3H8ClN3O2S
XLogP3-1.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass185.0025754 g/mol
Monoisotopic Mass185.0025754 g/mol
Topological Polar Surface Area107 Ų
Heavy Atom Count10
Formal Charge0
Complexity216
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
Flag Turkey
Digital Content Digital Content
106649-95-0
Famotidine
Pluvia Consumer Health is a multinational pharmaceutical company with its head office in Turkey/Istanbul ...
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 & Finished Dosage Form medications in the field of opioid medications, cosmeceuticals & also nutraceutical supplements with modern processing systems. Since manufacturing of our products are being done by ourselves and based on our own specific know-how from A to Z, therefore, we are able to support you in documentation, formulation & scientific matters as well as supplying you with high-quality products at unrivaled prices including different types of APIs.
Pluviaendo

IPS 2024

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