N-(4-methylphenyl)-4-[4-(phenylsulfonyl)piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-(4-methylphenyl)-4-[4-(phenylsulfonyl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: 4-[4-(benzenesulfonyl)piperazine-1-carbonyl]-N-(p-tolyl)benzenesulfonamide CAS Name: 4-[[4-(benzenesulfonyl)-1-piperazinyl]-oxomethyl]-N-(4-methylphenyl)benzenesulfonamide IUPAC Name: 4-[4-(benzenesulfonyl)piperazine-1-carbonyl]-N-(4-methylphenyl)benzenesulfonamide Traditional Name: 4-(4-besylpiperazine-1-carbonyl)-N-(p-tolyl)benzenesulfonamide Formula: C24H25N3O5S2 MolecularWeight: 499.6024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H25N3O5S2/c1-19-7-11-21(12-8-19)25-33(29,30)22-13-9-20(10-14-22)24(28)26-15-17-27(18-16-26)34(31,32)23-5-3-2-4-6-23/h2-14,25H,15-18H2,1H3