2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-N-[2-(cyanomethylsulfanyl)phenyl]ethanamide

Systemtic Name: 2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-N-[2-(cyanomethylsulfanyl)phenyl]ethanamide Openeye Name: 2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-N-[2-(cyanomethylsulfanyl)phenyl]acetamide CAS Name: 2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-N-[2-(cyanomethylthio)phenyl]acetamide IUPAC Name: 2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-N-[2-(cyanomethylsulfanyl)phenyl]acetamide Traditional Name: N-[2-(cyanomethylthio)phenyl]-2-[methyl(piperonyl)amino]acetamide Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)OCO2)CC(=O)NC3=CC=CC=C3SCC#N

Isomeric SMILES

CN(CC1=CC2=C(C=C1)OCO2)CC(=O)NC3=CC=CC=C3SCC#N

InChI

InChI=1S/C19H19N3O3S/c1-22(11-14-6-7-16-17(10-14)25-13-24-16)12-19(23)21-15-4-2-3-5-18(15)26-9-8-20/h2-7,10H,9,11-13H2,1H3,(H,21,23)