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

Systemtic Name: 2-[2-[[4-(azepan-4-yl)pyrimidin-2-yl]amino]-1-piperidin-1-yl-cyclohexyl]ethanamide Openeye Name: 2-[2-[[4-(azepan-4-yl)pyrimidin-2-yl]amino]-1-(1-piperidyl)cyclohexyl]acetamide CAS Name: 2-[2-[[4-(4-azepanyl)-2-pyrimidinyl]amino]-1-(1-piperidinyl)cyclohexyl]acetamide IUPAC Name: 2-[2-[[4-(azepan-4-yl)pyrimidin-2-yl]amino]-1-piperidin-1-ylcyclohexyl]acetamide Traditional Name: 2-[2-[[4-(azepan-4-yl)pyrimidin-2-yl]amino]-1-piperidino-cyclohexyl]acetamide Formula: C23H38N6O MolecularWeight: 414.58742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H38N6O/c24-21(30)17-23(29-15-4-1-5-16-29)11-3-2-8-20(23)28-22-26-14-10-19(27-22)18-7-6-12-25-13-9-18/h10,14,18,20,25H,1-9,11-13,15-17H2,(H2,24,30)(H,26,27,28)