N-(4-butylphenyl)-3-(4-ethanoylpiperazin-1-yl)carbonyl-4-methyl-benzenesulfonamide

Systemtic Name: N-(4-butylphenyl)-3-(4-ethanoylpiperazin-1-yl)carbonyl-4-methyl-benzenesulfonamide Openeye Name: 3-(4-acetylpiperazine-1-carbonyl)-N-(4-butylphenyl)-4-methyl-benzenesulfonamide CAS Name: 3-[(4-acetyl-1-piperazinyl)-oxomethyl]-N-(4-butylphenyl)-4-methylbenzenesulfonamide IUPAC Name: 3-(4-acetylpiperazine-1-carbonyl)-N-(4-butylphenyl)-4-methylbenzenesulfonamide Traditional Name: 3-(4-acetylpiperazine-1-carbonyl)-N-(4-butylphenyl)-4-methyl-benzenesulfonamide Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H31N3O4S/c1-4-5-6-20-8-10-21(11-9-20)25-32(30,31)22-12-7-18(2)23(17-22)24(29)27-15-13-26(14-16-27)19(3)28/h7-12,17,25H,4-6,13-16H2,1-3H3