N-[1-(2-methylpropanoyl)piperidin-4-yl]-4-methylsulfanyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide

Systemtic Name: N-[1-(2-methylpropanoyl)piperidin-4-yl]-4-methylsulfanyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide Openeye Name: N-[1-(2-methylpropanoyl)-4-piperidyl]-4-methylsulfanyl-2-[[(E)-styryl]sulfonylamino]butanamide CAS Name: N-[1-(2-methyl-1-oxopropyl)-4-piperidinyl]-4-(methylthio)-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide IUPAC Name: N-[1-(2-methylpropanoyl)piperidin-4-yl]-4-methylsulfanyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide Traditional Name: N-(1-isobutyryl-4-piperidyl)-4-(methylthio)-2-[[(E)-styryl]sulfonylamino]butyramide Formula: C22H33N3O4S2 MolecularWeight: 467.64512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCC(CC1)NC(=O)C(CCSC)NS(=O)(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CC(C)C(=O)N1CCC(CC1)NC(=O)C(CCSC)NS(=O)(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C22H33N3O4S2/c1-17(2)22(27)25-13-9-19(10-14-25)23-21(26)20(11-15-30-3)24-31(28,29)16-12-18-7-5-4-6-8-18/h4-8,12,16-17,19-20,24H,9-11,13-15H2,1-3H3,(H,23,26)/b16-12+