N-[2-(2-cyanoethylsulfanyl)phenyl]-3,4,5-trimethoxy-benzamide

Systemtic Name: N-[2-(2-cyanoethylsulfanyl)phenyl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[2-(2-cyanoethylsulfanyl)phenyl]-3,4,5-trimethoxy-benzamide CAS Name: N-[2-(2-cyanoethylthio)phenyl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[2-(2-cyanoethylsulfanyl)phenyl]-3,4,5-trimethoxybenzamide Traditional Name: N-[2-(2-cyanoethylthio)phenyl]-3,4,5-trimethoxy-benzamide Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NC2=CC=CC=C2SCCC#N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NC2=CC=CC=C2SCCC#N

InChI

InChI=1S/C19H20N2O4S/c1-23-15-11-13(12-16(24-2)18(15)25-3)19(22)21-14-7-4-5-8-17(14)26-10-6-9-20/h4-5,7-8,11-12H,6,10H2,1-3H3,(H,21,22)