N-[4-(cyanomethylsulfanyl)phenyl]-3-methoxy-benzamide

Systemtic Name: N-[4-(cyanomethylsulfanyl)phenyl]-3-methoxy-benzamide Openeye Name: N-[4-(cyanomethylsulfanyl)phenyl]-3-methoxy-benzamide CAS Name: N-[4-(cyanomethylthio)phenyl]-3-methoxybenzamide IUPAC Name: N-[4-(cyanomethylsulfanyl)phenyl]-3-methoxybenzamide Traditional Name: N-[4-(cyanomethylthio)phenyl]-3-methoxy-benzamide Formula: C16H14N2O2S MolecularWeight: 298.35956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)SCC#N

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)SCC#N

InChI

InChI=1S/C16H14N2O2S/c1-20-14-4-2-3-12(11-14)16(19)18-13-5-7-15(8-6-13)21-10-9-17/h2-8,11H,10H2,1H3,(H,18,19)