N-(2-cyanoethyl)-6-(phenylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-(2-cyanoethyl)-6-(phenylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: 6-benzylsulfanyl-N-(2-cyanoethyl)pyridine-3-carboxamide CAS Name: N-(2-cyanoethyl)-6-(phenylmethylthio)-3-pyridinecarboxamide IUPAC Name: 6-benzylsulfanyl-N-(2-cyanoethyl)pyridine-3-carboxamide Traditional Name: 6-(benzylthio)-N-(2-cyanoethyl)nicotinamide Formula: C16H15N3OS MolecularWeight: 297.3748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3OS/c17-9-4-10-18-16(20)14-7-8-15(19-11-14)21-12-13-5-2-1-3-6-13/h1-3,5-8,11H,4,10,12H2,(H,18,20)