4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-N-(2-methylsulfanylphenyl)benzamide

Systemtic Name: 4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-N-(2-methylsulfanylphenyl)benzamide Openeye Name: N-(2-methylsulfanylphenyl)-4-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]benzamide CAS Name: 4-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]-N-[2-(methylthio)phenyl]benzamide IUPAC Name: 4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-N-(2-methylsulfanylphenyl)benzamide Traditional Name: N-[2-(methylthio)phenyl]-4-[(4-tosylpiperazino)methyl]benzamide Formula: C26H29N3O3S2 MolecularWeight: 495.65676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4SC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4SC

InChI

InChI=1S/C26H29N3O3S2/c1-20-7-13-23(14-8-20)34(31,32)29-17-15-28(16-18-29)19-21-9-11-22(12-10-21)26(30)27-24-5-3-4-6-25(24)33-2/h3-14H,15-19H2,1-2H3,(H,27,30)