4-methylsulfanyl-2-[[(E)-2-phenylethenyl]sulfonylamino]-N-(3,4,5-trimethoxyphenyl)butanamide

Systemtic Name: 4-methylsulfanyl-2-[[(E)-2-phenylethenyl]sulfonylamino]-N-(3,4,5-trimethoxyphenyl)butanamide Openeye Name: 4-methylsulfanyl-2-[[(E)-styryl]sulfonylamino]-N-(3,4,5-trimethoxyphenyl)butanamide CAS Name: 4-(methylthio)-2-[[(E)-2-phenylethenyl]sulfonylamino]-N-(3,4,5-trimethoxyphenyl)butanamide IUPAC Name: 4-methylsulfanyl-2-[[(E)-2-phenylethenyl]sulfonylamino]-N-(3,4,5-trimethoxyphenyl)butanamide Traditional Name: 4-(methylthio)-2-[[(E)-styryl]sulfonylamino]-N-(3,4,5-trimethoxyphenyl)butyramide Formula: C22H28N2O6S2 MolecularWeight: 480.59752

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=O)C(CCSC)NS(=O)(=O)C=CC2=CC=CC=C2

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=O)C(CCSC)NS(=O)(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C22H28N2O6S2/c1-28-19-14-17(15-20(29-2)21(19)30-3)23-22(25)18(10-12-31-4)24-32(26,27)13-11-16-8-6-5-7-9-16/h5-9,11,13-15,18,24H,10,12H2,1-4H3,(H,23,25)/b13-11+