2-(4-acetamidophenyl)sulfanyl-N-(cyanomethyl)-N-phenyl-ethanamide

Systemtic Name: 2-(4-acetamidophenyl)sulfanyl-N-(cyanomethyl)-N-phenyl-ethanamide Openeye Name: 2-(4-acetamidophenyl)sulfanyl-N-(cyanomethyl)-N-phenyl-acetamide CAS Name: 2-[(4-acetamidophenyl)thio]-N-(cyanomethyl)-N-phenylacetamide IUPAC Name: 2-(4-acetamidophenyl)sulfanyl-N-(cyanomethyl)-N-phenylacetamide Traditional Name: 2-[(4-acetamidophenyl)thio]-N-(cyanomethyl)-N-phenyl-acetamide Formula: C18H17N3O2S MolecularWeight: 339.41148

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SCC(=O)N(CC#N)C2=CC=CC=C2

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SCC(=O)N(CC#N)C2=CC=CC=C2

InChI

InChI=1S/C18H17N3O2S/c1-14(22)20-15-7-9-17(10-8-15)24-13-18(23)21(12-11-19)16-5-3-2-4-6-16/h2-10H,12-13H2,1H3,(H,20,22)