N-[1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]pyrazol-4-yl]benzenesulfonamide

Systemtic Name: N-[1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]pyrazol-4-yl]benzenesulfonamide Openeye Name: N-[1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]pyrazol-4-yl]benzenesulfonamide CAS Name: N-[1-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-4-pyrazolyl]benzenesulfonamide IUPAC Name: N-[1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]pyrazol-4-yl]benzenesulfonamide Traditional Name: N-[1-[4-[4-(2-pyrimidyl)piperazino]butyl]pyrazol-4-yl]benzenesulfonamide Formula: C21H27N7O2S MolecularWeight: 441.54978

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCN2C=C(C=N2)NS(=O)(=O)C3=CC=CC=C3)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCN1CCCCN2C=C(C=N2)NS(=O)(=O)C3=CC=CC=C3)C4=NC=CC=N4

InChI

InChI=1S/C21H27N7O2S/c29-31(30,20-7-2-1-3-8-20)25-19-17-24-28(18-19)12-5-4-11-26-13-15-27(16-14-26)21-22-9-6-10-23-21/h1-3,6-10,17-18,25H,4-5,11-16H2