N-phenyl-1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]pyrazole-4-sulfonamide

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCN2C=C(C=N2)S(=O)(=O)NC3=CC=CC=C3)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCN1CCCCN2C=C(C=N2)S(=O)(=O)NC3=CC=CC=C3)C4=NC=CC=N4

InChI

InChI=1S/C21H27N7O2S/c29-31(30,25-19-7-2-1-3-8-19)20-17-24-28(18-20)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