2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(2-prop-2-enylsulfanylphenyl)ethanamide

Systemtic Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(2-prop-2-enylsulfanylphenyl)ethanamide Openeye Name: N-(2-allylsulfanylphenyl)-2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: 2-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-N-[2-(prop-2-enylthio)phenyl]acetamide IUPAC Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(2-prop-2-enylsulfanylphenyl)acetamide Traditional Name: N-[2-(allylthio)phenyl]-2-[4-(3,4-dimethylphenyl)sulfonylpiperazino]acetamide Formula: C23H29N3O3S2 MolecularWeight: 459.62466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC=CC=C3SCC=C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC=CC=C3SCC=C)C

InChI

InChI=1S/C23H29N3O3S2/c1-4-15-30-22-8-6-5-7-21(22)24-23(27)17-25-11-13-26(14-12-25)31(28,29)20-10-9-18(2)19(3)16-20/h4-10,16H,1,11-15,17H2,2-3H3,(H,24,27)