N-(2-acetamidoethyl)-2-phenylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-(2-acetamidoethyl)-2-phenylsulfanyl-pyridine-3-carboxamide Openeye Name: N-(2-acetamidoethyl)-2-phenylsulfanyl-pyridine-3-carboxamide CAS Name: N-(2-acetamidoethyl)-2-(phenylthio)-3-pyridinecarboxamide IUPAC Name: N-(2-acetamidoethyl)-2-phenylsulfanylpyridine-3-carboxamide Traditional Name: N-(2-acetamidoethyl)-2-(phenylthio)nicotinamide Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC(=O)C1=C(N=CC=C1)SC2=CC=CC=C2

Isomeric SMILES

CC(=O)NCCNC(=O)C1=C(N=CC=C1)SC2=CC=CC=C2

InChI

InChI=1S/C16H17N3O2S/c1-12(20)17-10-11-18-15(21)14-8-5-9-19-16(14)22-13-6-3-2-4-7-13/h2-9H,10-11H2,1H3,(H,17,20)(H,18,21)