3,4-bis(chloranyl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)carbonylphenyl]benzenesulfonamide

Systemtic Name: 3,4-bis(chloranyl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)carbonylphenyl]benzenesulfonamide Openeye Name: 3,4-dichloro-N-[3-(4-pyrimidin-2-ylpiperazine-1-carbonyl)phenyl]benzenesulfonamide CAS Name: 3,4-dichloro-N-[3-[oxo-[4-(2-pyrimidinyl)-1-piperazinyl]methyl]phenyl]benzenesulfonamide IUPAC Name: 3,4-dichloro-N-[3-(4-pyrimidin-2-ylpiperazine-1-carbonyl)phenyl]benzenesulfonamide Traditional Name: 3,4-dichloro-N-[3-[4-(2-pyrimidyl)piperazine-1-carbonyl]phenyl]benzenesulfonamide Formula: C21H19Cl2N5O3S MolecularWeight: 492.37826

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CC(=CC=C3)NS(=O)(=O)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CC(=CC=C3)NS(=O)(=O)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C21H19Cl2N5O3S/c22-18-6-5-17(14-19(18)23)32(30,31)26-16-4-1-3-15(13-16)20(29)27-9-11-28(12-10-27)21-24-7-2-8-25-21/h1-8,13-14,26H,9-12H2