N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]ethanamide

Systemtic Name: N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]ethanamide Openeye Name: N-[2-(2-amino-2-oxo-ethyl)sulfanylphenyl]-2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]acetamide CAS Name: N-[2-[(2-amino-2-oxoethyl)thio]phenyl]-2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]acetamide IUPAC Name: N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]-2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]acetamide Traditional Name: N-[2-[(2-amino-2-keto-ethyl)thio]phenyl]-2-[methyl(piperonyl)amino]acetamide Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O4S/c1-22(9-13-6-7-15-16(8-13)26-12-25-15)10-19(24)21-14-4-2-3-5-17(14)27-11-18(20)23/h2-8H,9-12H2,1H3,(H2,20,23)(H,21,24)