N-(1,3-benzodioxol-5-ylmethylideneamino)-2-[methylsulfonyl(phenethyl)amino]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethylideneamino)-2-[methylsulfonyl(phenethyl)amino]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyleneamino)-2-[methylsulfonyl(phenethyl)amino]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethylideneamino)-2-[methylsulfonyl(phenethyl)amino]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethylideneamino)-2-[methylsulfonyl(phenethyl)amino]acetamide Traditional Name: 2-[mesyl(phenethyl)amino]-N-(piperonylideneamino)acetamide Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCC1=CC=CC=C1)CC(=O)NN=CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CS(=O)(=O)N(CCC1=CC=CC=C1)CC(=O)NN=CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H21N3O5S/c1-28(24,25)22(10-9-15-5-3-2-4-6-15)13-19(23)21-20-12-16-7-8-17-18(11-16)27-14-26-17/h2-8,11-12H,9-10,13-14H2,1H3,(H,21,23)