2-(3-azanylpyridin-4-yl)sulfanyl-N-(cyanomethyl)-N-phenyl-ethanamide

Systemtic Name: 2-(3-azanylpyridin-4-yl)sulfanyl-N-(cyanomethyl)-N-phenyl-ethanamide Openeye Name: 2-[(3-amino-4-pyridyl)sulfanyl]-N-(cyanomethyl)-N-phenyl-acetamide CAS Name: 2-[(3-amino-4-pyridinyl)thio]-N-(cyanomethyl)-N-phenylacetamide IUPAC Name: 2-(3-aminopyridin-4-yl)sulfanyl-N-(cyanomethyl)-N-phenylacetamide Traditional Name: 2-[(3-amino-4-pyridyl)thio]-N-(cyanomethyl)-N-phenyl-acetamide Formula: C15H14N4OS MolecularWeight: 298.36286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CC#N)C(=O)CSC2=C(C=NC=C2)N

Isomeric SMILES

C1=CC=C(C=C1)N(CC#N)C(=O)CSC2=C(C=NC=C2)N

InChI

InChI=1S/C15H14N4OS/c16-7-9-19(12-4-2-1-3-5-12)15(20)11-21-14-6-8-18-10-13(14)17/h1-6,8,10H,9,11,17H2