4-(azepan-1-yl)-N-[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]pyrimidin-2-amine

Systemtic Name: 4-(azepan-1-yl)-N-[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]pyrimidin-2-amine Openeye Name: 4-(azepan-1-yl)-N-[1-[(2-methoxyphenyl)methyl]-4-piperidyl]pyrimidin-2-amine CAS Name: 4-(1-azepanyl)-N-[1-[(2-methoxyphenyl)methyl]-4-piperidinyl]-2-pyrimidinamine IUPAC Name: 4-(azepan-1-yl)-N-[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]pyrimidin-2-amine Traditional Name: [4-(azepan-1-yl)pyrimidin-2-yl]-(1-o-anisyl-4-piperidyl)amine Formula: C23H33N5O MolecularWeight: 395.54102

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN2CCC(CC2)NC3=NC=CC(=N3)N4CCCCCC4

Isomeric SMILES

COC1=CC=CC=C1CN2CCC(CC2)NC3=NC=CC(=N3)N4CCCCCC4

InChI

InChI=1S/C23H33N5O/c1-29-21-9-5-4-8-19(21)18-27-16-11-20(12-17-27)25-23-24-13-10-22(26-23)28-14-6-2-3-7-15-28/h4-5,8-10,13,20H,2-3,6-7,11-12,14-18H2,1H3,(H,24,25,26)