N-[4-[4-(2-phenylbutanoyl)piperazin-1-yl]-3-pyrrolidin-1-ylcarbonyl-phenyl]benzenesulfonamide

Systemtic Name: N-[4-[4-(2-phenylbutanoyl)piperazin-1-yl]-3-pyrrolidin-1-ylcarbonyl-phenyl]benzenesulfonamide Openeye Name: N-[4-[4-(2-phenylbutanoyl)piperazin-1-yl]-3-(pyrrolidine-1-carbonyl)phenyl]benzenesulfonamide CAS Name: N-[4-[4-(1-oxo-2-phenylbutyl)-1-piperazinyl]-3-[oxo(1-pyrrolidinyl)methyl]phenyl]benzenesulfonamide IUPAC Name: N-[4-[4-(2-phenylbutanoyl)piperazin-1-yl]-3-(pyrrolidine-1-carbonyl)phenyl]benzenesulfonamide Traditional Name: N-[4-[4-(2-phenylbutanoyl)piperazino]-3-(pyrrolidine-1-carbonyl)phenyl]benzenesulfonamide Formula: C31H36N4O4S MolecularWeight: 560.70694

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)NS(=O)(=O)C4=CC=CC=C4)C(=O)N5CCCC5

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)NS(=O)(=O)C4=CC=CC=C4)C(=O)N5CCCC5

InChI

InChI=1S/C31H36N4O4S/c1-2-27(24-11-5-3-6-12-24)30(36)35-21-19-33(20-22-35)29-16-15-25(23-28(29)31(37)34-17-9-10-18-34)32-40(38,39)26-13-7-4-8-14-26/h3-8,11-16,23,27,32H,2,9-10,17-22H2,1H3