N-(4-ethoxyphenyl)-4-[4-(3-methylphenyl)piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-(4-ethoxyphenyl)-4-[4-(3-methylphenyl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-(4-ethoxyphenyl)-4-[4-(m-tolyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: N-(4-ethoxyphenyl)-4-[[4-(3-methylphenyl)-1-piperazinyl]-oxomethyl]benzenesulfonamide IUPAC Name: N-(4-ethoxyphenyl)-4-[4-(3-methylphenyl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: 4-[4-(m-tolyl)piperazine-1-carbonyl]-N-p-phenetyl-benzenesulfonamide Formula: C26H29N3O4S MolecularWeight: 479.59116

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC(=C4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC(=C4)C

InChI

InChI=1S/C26H29N3O4S/c1-3-33-24-11-9-22(10-12-24)27-34(31,32)25-13-7-21(8-14-25)26(30)29-17-15-28(16-18-29)23-6-4-5-20(2)19-23/h4-14,19,27H,3,15-18H2,1-2H3