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

Systemtic Name: 4-(azepan-1-yl)-N-[(2E)-1-piperidin-1-yl-2-prop-2-enoxyimino-cyclohexyl]pyrimidin-2-amine Openeye Name: N-[(2E)-2-allyloxyimino-1-(1-piperidyl)cyclohexyl]-4-(azepan-1-yl)pyrimidin-2-amine CAS Name: 4-(1-azepanyl)-N-[(2E)-1-(1-piperidinyl)-2-prop-2-enoxyiminocyclohexyl]-2-pyrimidinamine IUPAC Name: 4-(azepan-1-yl)-N-[(2E)-1-piperidin-1-yl-2-prop-2-enoxyiminocyclohexyl]pyrimidin-2-amine Traditional Name: [(2E)-2-allyloximino-1-piperidino-cyclohexyl]-[4-(azepan-1-yl)pyrimidin-2-yl]amine Formula: C24H38N6O MolecularWeight: 426.59812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H38N6O/c1-2-20-31-28-21-12-6-7-14-24(21,30-18-10-5-11-19-30)27-23-25-15-13-22(26-23)29-16-8-3-4-9-17-29/h2,13,15H,1,3-12,14,16-20H2,(H,25,26,27)/b28-21+