4-(2-methylpropyl)-N-(2-oxidanylidene-2-piperazin-1-yl-ethyl)-N-pentyl-benzenesulfonamide

Systemtic Name: 4-(2-methylpropyl)-N-(2-oxidanylidene-2-piperazin-1-yl-ethyl)-N-pentyl-benzenesulfonamide Openeye Name: 4-isobutyl-N-(2-oxo-2-piperazin-1-yl-ethyl)-N-pentyl-benzenesulfonamide CAS Name: 4-(2-methylpropyl)-N-[2-oxo-2-(1-piperazinyl)ethyl]-N-pentylbenzenesulfonamide IUPAC Name: 4-(2-methylpropyl)-N-(2-oxo-2-piperazin-1-ylethyl)-N-pentylbenzenesulfonamide Traditional Name: N-amyl-4-isobutyl-N-(2-keto-2-piperazino-ethyl)benzenesulfonamide Formula: C21H35N3O3S MolecularWeight: 409.5859

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC(=O)N1CCNCC1)S(=O)(=O)C2=CC=C(C=C2)CC(C)C

Isomeric SMILES

CCCCCN(CC(=O)N1CCNCC1)S(=O)(=O)C2=CC=C(C=C2)CC(C)C

InChI

InChI=1S/C21H35N3O3S/c1-4-5-6-13-24(17-21(25)23-14-11-22-12-15-23)28(26,27)20-9-7-19(8-10-20)16-18(2)3/h7-10,18,22H,4-6,11-17H2,1-3H3