N-butan-2-yl-4-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-butan-2-yl-4-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: 4-[4-[(4-cyanophenyl)methyl]piperazine-1-carbonyl]-N-sec-butyl-benzenesulfonamide CAS Name: N-butan-2-yl-4-[[4-[(4-cyanophenyl)methyl]-1-piperazinyl]-oxomethyl]benzenesulfonamide IUPAC Name: N-butan-2-yl-4-[4-[(4-cyanophenyl)methyl]piperazine-1-carbonyl]benzenesulfonamide Traditional Name: 4-[4-(4-cyanobenzyl)piperazine-1-carbonyl]-N-sec-butyl-benzenesulfonamide Formula: C23H28N4O3S MolecularWeight: 440.55842

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=C(C=C3)C#N

Isomeric SMILES

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C23H28N4O3S/c1-3-18(2)25-31(29,30)22-10-8-21(9-11-22)23(28)27-14-12-26(13-15-27)17-20-6-4-19(16-24)5-7-20/h4-11,18,25H,3,12-15,17H2,1-2H3