2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-N-(2-methylsulfanylphenyl)ethanamide

Systemtic Name: 2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-N-(2-methylsulfanylphenyl)ethanamide Openeye Name: N-(2-methylsulfanylphenyl)-2-[4-(4-sec-butylphenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: 2-[4-(4-butan-2-ylphenyl)sulfonyl-1-piperazinyl]-N-[2-(methylthio)phenyl]acetamide IUPAC Name: 2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-N-(2-methylsulfanylphenyl)acetamide Traditional Name: N-[2-(methylthio)phenyl]-2-[4-(4-sec-butylphenyl)sulfonylpiperazino]acetamide Formula: C23H31N3O3S2 MolecularWeight: 461.64054

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC=CC=C3SC

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC=CC=C3SC

InChI

InChI=1S/C23H31N3O3S2/c1-4-18(2)19-9-11-20(12-10-19)31(28,29)26-15-13-25(14-16-26)17-23(27)24-21-7-5-6-8-22(21)30-3/h5-12,18H,4,13-17H2,1-3H3,(H,24,27)