4-(azepan-1-yl)-N-[(2E)-2-(2-methylpropoxyimino)-1-piperidin-1-yl-cyclohexyl]pyrimidin-2-amine

Systemtic Name: 4-(azepan-1-yl)-N-[(2E)-2-(2-methylpropoxyimino)-1-piperidin-1-yl-cyclohexyl]pyrimidin-2-amine Openeye Name: 4-(azepan-1-yl)-N-[(2E)-2-isobutoxyimino-1-(1-piperidyl)cyclohexyl]pyrimidin-2-amine CAS Name: 4-(1-azepanyl)-N-[(2E)-2-(2-methylpropoxyimino)-1-(1-piperidinyl)cyclohexyl]-2-pyrimidinamine IUPAC Name: 4-(azepan-1-yl)-N-[(2E)-2-(2-methylpropoxyimino)-1-piperidin-1-ylcyclohexyl]pyrimidin-2-amine Traditional Name: [4-(azepan-1-yl)pyrimidin-2-yl]-[(2E)-2-isobutyloximino-1-piperidino-cyclohexyl]amine Formula: C25H42N6O MolecularWeight: 442.64058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CON=C1CCCCC1(NC2=NC=CC(=N2)N3CCCCCC3)N4CCCCC4

Isomeric SMILES

CC(C)CO/N=C/1\CCCCC1(NC2=NC=CC(=N2)N3CCCCCC3)N4CCCCC4

InChI

InChI=1S/C25H42N6O/c1-21(2)20-32-29-22-12-6-7-14-25(22,31-18-10-5-11-19-31)28-24-26-15-13-23(27-24)30-16-8-3-4-9-17-30/h13,15,21H,3-12,14,16-20H2,1-2H3,(H,26,27,28)/b29-22+