[2-[[4-(azepan-4-yl)pyrimidin-2-yl]amino]-1-piperidin-1-yl-cyclohexyl]methanesulfonamide

Systemtic Name: [2-[[4-(azepan-4-yl)pyrimidin-2-yl]amino]-1-piperidin-1-yl-cyclohexyl]methanesulfonamide Openeye Name: [2-[[4-(azepan-4-yl)pyrimidin-2-yl]amino]-1-(1-piperidyl)cyclohexyl]methanesulfonamide CAS Name: [2-[[4-(4-azepanyl)-2-pyrimidinyl]amino]-1-(1-piperidinyl)cyclohexyl]methanesulfonamide IUPAC Name: [2-[[4-(azepan-4-yl)pyrimidin-2-yl]amino]-1-piperidin-1-ylcyclohexyl]methanesulfonamide Traditional Name: [2-[[4-(azepan-4-yl)pyrimidin-2-yl]amino]-1-piperidino-cyclohexyl]methanesulfonamide Formula: C22H38N6O2S MolecularWeight: 450.64112

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2(CCCCC2NC3=NC=CC(=N3)C4CCCNCC4)CS(=O)(=O)N

Isomeric SMILES

C1CCN(CC1)C2(CCCCC2NC3=NC=CC(=N3)C4CCCNCC4)CS(=O)(=O)N

InChI

InChI=1S/C22H38N6O2S/c23-31(29,30)17-22(28-15-4-1-5-16-28)11-3-2-8-20(22)27-21-25-14-10-19(26-21)18-7-6-12-24-13-9-18/h10,14,18,20,24H,1-9,11-13,15-17H2,(H2,23,29,30)(H,25,26,27)