N-[5-[4-(2,5-dimethylphenyl)piperazin-1-yl]carbonyl-2-(4-methylphenyl)sulfonyl-phenyl]ethanamide

Systemtic Name: N-[5-[4-(2,5-dimethylphenyl)piperazin-1-yl]carbonyl-2-(4-methylphenyl)sulfonyl-phenyl]ethanamide Openeye Name: N-[5-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-2-(p-tolylsulfonyl)phenyl]acetamide CAS Name: N-[5-[[4-(2,5-dimethylphenyl)-1-piperazinyl]-oxomethyl]-2-(4-methylphenyl)sulfonylphenyl]acetamide IUPAC Name: N-[5-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-2-(4-methylphenyl)sulfonylphenyl]acetamide Traditional Name: N-[5-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-2-tosyl-phenyl]acetamide Formula: C28H31N3O4S MolecularWeight: 505.62844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H31N3O4S/c1-19-6-10-24(11-7-19)36(34,35)27-12-9-23(18-25(27)29-22(4)32)28(33)31-15-13-30(14-16-31)26-17-20(2)5-8-21(26)3/h5-12,17-18H,13-16H2,1-4H3,(H,29,32)