(2S)-N-(1,3-benzodioxol-5-yl)-3-methyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide

Systemtic Name: (2S)-N-(1,3-benzodioxol-5-yl)-3-methyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide Openeye Name: (2S)-N-(1,3-benzodioxol-5-yl)-3-methyl-2-[[(E)-styryl]sulfonylamino]butanamide CAS Name: (2S)-N-(1,3-benzodioxol-5-yl)-3-methyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide IUPAC Name: (2S)-N-(1,3-benzodioxol-5-yl)-3-methyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide Traditional Name: (2S)-N-(1,3-benzodioxol-5-yl)-3-methyl-2-[[(E)-styryl]sulfonylamino]butyramide Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC2=C(C=C1)OCO2)NS(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=CC2=C(C=C1)OCO2)NS(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C20H22N2O5S/c1-14(2)19(22-28(24,25)11-10-15-6-4-3-5-7-15)20(23)21-16-8-9-17-18(12-16)27-13-26-17/h3-12,14,19,22H,13H2,1-2H3,(H,21,23)/b11-10+/t19-/m0/s1