4,6-Pyrimidinediamine, 2-(methylthio)-5-nitroso- structure

4,6-Pyrimidinediamine, 2-(methylthio)-5-nitroso-

2-methylsulfanyl-5-nitrosopyrimidine-4,6-diamine

Also Known As: 4,6-Pyrimidinediamine, 2-(methylthio)-5-nitroso-|2-methylsulfanyl-5-nitrosopyrimidine-4,6-diamine|2-(methylsulfanyl)-5-nitrosopyrimidine-4,6-diamine|2-(Methylthio)-5-nitrosopyrimidine-4,6-diamine|2-methylthio-5-nitrosopyrimidine-4,6-diamine|4,6-diamino-2-methylthio-5-nitrosopyrimidine|6-amino-2-(methylsulfanyl)-5-nitrosopyrimidin-4-ylamine|J2.453.652A|2-Methylsulfanyl-5-nitroso-pyrimidine-4,6-diamine|AB-323/25048339

CAS: 52222-43-2
Molecular Formula C5H7N5OS
Molecular Weight 185.03712 g/mol
LogP 0.3
Topological Polar Surface Area 133.0 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 7
Rotatable Bonds 1
Exact Mass 185.03712
Monoisotopic Mass 185.03712
Heavy Atoms 12
Complexity 156.0

Chemical Identifiers

CAS Number 52222-43-2
SMILES CSC1=NC(=C(C(=N1)N)N=O)N
InChIKey QHDIORZOMVHNGS-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.

Heterocyclic Building Blocks (13 patents) Pharmaceutical Intermediates (45 patents)

Product Overview

4,6-Pyrimidinediamine, 2-(methylthio)-5-nitroso- (CAS 52222-43-2), with molecular formula C5H7N5OS and molecular weight 185.03712 g/mol. IUPAC: 2-methylsulfanyl-5-nitrosopyrimidine-4,6-diamine.

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