N-(4-butylphenyl)-5-(4-cyclopropylcarbonylpiperazin-1-yl)carbonyl-2-methyl-benzenesulfonamide

Systemtic Name: N-(4-butylphenyl)-5-(4-cyclopropylcarbonylpiperazin-1-yl)carbonyl-2-methyl-benzenesulfonamide Openeye Name: N-(4-butylphenyl)-5-[4-(cyclopropanecarbonyl)piperazine-1-carbonyl]-2-methyl-benzenesulfonamide CAS Name: N-(4-butylphenyl)-5-[[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]-oxomethyl]-2-methylbenzenesulfonamide IUPAC Name: N-(4-butylphenyl)-5-[4-(cyclopropanecarbonyl)piperazine-1-carbonyl]-2-methylbenzenesulfonamide Traditional Name: N-(4-butylphenyl)-5-[4-(cyclopropanecarbonyl)piperazine-1-carbonyl]-2-methyl-benzenesulfonamide Formula: C26H33N3O4S MolecularWeight: 483.62292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCN(CC3)C(=O)C4CC4)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCN(CC3)C(=O)C4CC4)C

InChI

InChI=1S/C26H33N3O4S/c1-3-4-5-20-7-12-23(13-8-20)27-34(32,33)24-18-22(9-6-19(24)2)26(31)29-16-14-28(15-17-29)25(30)21-10-11-21/h6-9,12-13,18,21,27H,3-5,10-11,14-17H2,1-2H3