N-(3-methylphenyl)-N-[[4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]carbonylphenyl]methyl]methanesulfonamide

Systemtic Name: N-(3-methylphenyl)-N-[[4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]carbonylphenyl]methyl]methanesulfonamide Openeye Name: N-(m-tolyl)-N-[[4-[4-(p-tolylsulfonyl)piperazine-1-carbonyl]phenyl]methyl]methanesulfonamide CAS Name: N-(3-methylphenyl)-N-[[4-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]phenyl]methyl]methanesulfonamide IUPAC Name: N-(3-methylphenyl)-N-[[4-[4-(4-methylphenyl)sulfonylpiperazine-1-carbonyl]phenyl]methyl]methanesulfonamide Traditional Name: N-(m-tolyl)-N-[4-(4-tosylpiperazine-1-carbonyl)benzyl]methanesulfonamide Formula: C27H31N3O5S2 MolecularWeight: 541.68214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)CN(C4=CC=CC(=C4)C)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)CN(C4=CC=CC(=C4)C)S(=O)(=O)C

InChI

InChI=1S/C27H31N3O5S2/c1-21-7-13-26(14-8-21)37(34,35)29-17-15-28(16-18-29)27(31)24-11-9-23(10-12-24)20-30(36(3,32)33)25-6-4-5-22(2)19-25/h4-14,19H,15-18,20H2,1-3H3