4-bromanyl-N-[[4-(4-pyrimidin-2-ylpiperazin-1-yl)carbonylcyclohexyl]methyl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[[4-(4-pyrimidin-2-ylpiperazin-1-yl)carbonylcyclohexyl]methyl]benzenesulfonamide Openeye Name: 4-bromo-N-[[4-(4-pyrimidin-2-ylpiperazine-1-carbonyl)cyclohexyl]methyl]benzenesulfonamide CAS Name: 4-bromo-N-[[4-[oxo-[4-(2-pyrimidinyl)-1-piperazinyl]methyl]cyclohexyl]methyl]benzenesulfonamide IUPAC Name: 4-bromo-N-[[4-(4-pyrimidin-2-ylpiperazine-1-carbonyl)cyclohexyl]methyl]benzenesulfonamide Traditional Name: 4-bromo-N-[[4-[4-(2-pyrimidyl)piperazine-1-carbonyl]cyclohexyl]methyl]benzenesulfonamide Formula: C22H28BrN5O3S MolecularWeight: 522.45842

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CNS(=O)(=O)C2=CC=C(C=C2)Br)C(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

C1CC(CCC1CNS(=O)(=O)C2=CC=C(C=C2)Br)C(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C22H28BrN5O3S/c23-19-6-8-20(9-7-19)32(30,31)26-16-17-2-4-18(5-3-17)21(29)27-12-14-28(15-13-27)22-24-10-1-11-25-22/h1,6-11,17-18,26H,2-5,12-16H2