(2S)-N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-2-(phenylsulfonylamino)butanamide

Systemtic Name: (2S)-N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-2-(phenylsulfonylamino)butanamide Openeye Name: (2S)-2-(benzenesulfonamido)-N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-butanamide CAS Name: (2S)-2-(benzenesulfonamido)-N-(1,3-benzodioxol-5-ylmethyl)-3-methylbutanamide IUPAC Name: (2S)-2-(benzenesulfonamido)-N-(1,3-benzodioxol-5-ylmethyl)-3-methylbutanamide Traditional Name: (2S)-2-(benzenesulfonamido)-3-methyl-N-piperonyl-butyramide Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CC2=C(C=C1)OCO2)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H](C(=O)NCC1=CC2=C(C=C1)OCO2)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H22N2O5S/c1-13(2)18(21-27(23,24)15-6-4-3-5-7-15)19(22)20-11-14-8-9-16-17(10-14)26-12-25-16/h3-10,13,18,21H,11-12H2,1-2H3,(H,20,22)/t18-/m0/s1