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

Systemtic Name: N-[[4-(4-pyrimidin-2-ylpiperazin-1-yl)carbonylcyclohexyl]methyl]benzenesulfonamide Openeye Name: N-[[4-(4-pyrimidin-2-ylpiperazine-1-carbonyl)cyclohexyl]methyl]benzenesulfonamide CAS Name: N-[[4-[oxo-[4-(2-pyrimidinyl)-1-piperazinyl]methyl]cyclohexyl]methyl]benzenesulfonamide IUPAC Name: N-[[4-(4-pyrimidin-2-ylpiperazine-1-carbonyl)cyclohexyl]methyl]benzenesulfonamide Traditional Name: N-[[4-[4-(2-pyrimidyl)piperazine-1-carbonyl]cyclohexyl]methyl]benzenesulfonamide Formula: C22H29N5O3S MolecularWeight: 443.56236

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N5O3S/c28-21(26-13-15-27(16-14-26)22-23-11-4-12-24-22)19-9-7-18(8-10-19)17-25-31(29,30)20-5-2-1-3-6-20/h1-6,11-12,18-19,25H,7-10,13-17H2