2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-(2-cyanoethyl)-N-methyl-ethanamide

Systemtic Name: 2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-(2-cyanoethyl)-N-methyl-ethanamide Openeye Name: 2-(4-amino-5-cyano-pyrimidin-2-yl)sulfanyl-N-(2-cyanoethyl)-N-methyl-acetamide CAS Name: 2-[(4-amino-5-cyano-2-pyrimidinyl)thio]-N-(2-cyanoethyl)-N-methylacetamide IUPAC Name: 2-(4-amino-5-cyanopyrimidin-2-yl)sulfanyl-N-(2-cyanoethyl)-N-methylacetamide Traditional Name: 2-[(4-amino-5-cyano-pyrimidin-2-yl)thio]-N-(2-cyanoethyl)-N-methyl-acetamide Formula: C11H12N6OS MolecularWeight: 276.31758

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)CSC1=NC=C(C(=N1)N)C#N

Isomeric SMILES

CN(CCC#N)C(=O)CSC1=NC=C(C(=N1)N)C#N

InChI

InChI=1S/C11H12N6OS/c1-17(4-2-3-12)9(18)7-19-11-15-6-8(5-13)10(14)16-11/h6H,2,4,7H2,1H3,(H2,14,15,16)