N-[[4-[4-(4-methoxyphenyl)piperazin-1-yl]carbonylphenyl]methyl]-2,5-dimethyl-benzenesulfonamide

Systemtic Name: N-[[4-[4-(4-methoxyphenyl)piperazin-1-yl]carbonylphenyl]methyl]-2,5-dimethyl-benzenesulfonamide Openeye Name: N-[[4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]phenyl]methyl]-2,5-dimethyl-benzenesulfonamide CAS Name: N-[[4-[[4-(4-methoxyphenyl)-1-piperazinyl]-oxomethyl]phenyl]methyl]-2,5-dimethylbenzenesulfonamide IUPAC Name: N-[[4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]phenyl]methyl]-2,5-dimethylbenzenesulfonamide Traditional Name: N-[4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]benzyl]-2,5-dimethyl-benzenesulfonamide Formula: C27H31N3O4S MolecularWeight: 493.61774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H31N3O4S/c1-20-4-5-21(2)26(18-20)35(32,33)28-19-22-6-8-23(9-7-22)27(31)30-16-14-29(15-17-30)24-10-12-25(34-3)13-11-24/h4-13,18,28H,14-17,19H2,1-3H3