N-[2-(cyanomethylsulfanyl)phenyl]-2-[(3,4-dimethoxyphenyl)methyl-methyl-amino]ethanamide

Systemtic Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-[(3,4-dimethoxyphenyl)methyl-methyl-amino]ethanamide Openeye Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-[(3,4-dimethoxyphenyl)methyl-methyl-amino]acetamide CAS Name: N-[2-(cyanomethylthio)phenyl]-2-[(3,4-dimethoxyphenyl)methyl-methylamino]acetamide IUPAC Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-[(3,4-dimethoxyphenyl)methyl-methylamino]acetamide Traditional Name: N-[2-(cyanomethylthio)phenyl]-2-[methyl(veratryl)amino]acetamide Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OC)OC)CC(=O)NC2=CC=CC=C2SCC#N

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OC)OC)CC(=O)NC2=CC=CC=C2SCC#N

InChI

InChI=1S/C20H23N3O3S/c1-23(13-15-8-9-17(25-2)18(12-15)26-3)14-20(24)22-16-6-4-5-7-19(16)27-11-10-21/h4-9,12H,11,13-14H2,1-3H3,(H,22,24)