4-(benzimidazol-1-yl)-N-[1-[1-(2-dimethoxyphosphorylethyl)piperidin-3-yl]ethyl]pyrimidin-2-amine

Systemtic Name: 4-(benzimidazol-1-yl)-N-[1-[1-(2-dimethoxyphosphorylethyl)piperidin-3-yl]ethyl]pyrimidin-2-amine Openeye Name: 4-(benzimidazol-1-yl)-N-[1-[1-(2-dimethoxyphosphorylethyl)-3-piperidyl]ethyl]pyrimidin-2-amine CAS Name: 4-(1-benzimidazolyl)-N-[1-[1-(2-dimethoxyphosphorylethyl)-3-piperidinyl]ethyl]-2-pyrimidinamine IUPAC Name: 4-(benzimidazol-1-yl)-N-[1-[1-(2-dimethoxyphosphorylethyl)piperidin-3-yl]ethyl]pyrimidin-2-amine Traditional Name: [4-(benzimidazol-1-yl)pyrimidin-2-yl]-[1-[1-(2-dimethoxyphosphorylethyl)-3-piperidyl]ethyl]amine Formula: C22H31N6O3P MolecularWeight: 458.493701

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCN(C1)CCP(=O)(OC)OC)NC2=NC=CC(=N2)N3C=NC4=CC=CC=C43

Isomeric SMILES

CC(C1CCCN(C1)CCP(=O)(OC)OC)NC2=NC=CC(=N2)N3C=NC4=CC=CC=C43

InChI

InChI=1S/C22H31N6O3P/c1-17(18-7-6-12-27(15-18)13-14-32(29,30-2)31-3)25-22-23-11-10-21(26-22)28-16-24-19-8-4-5-9-20(19)28/h4-5,8-11,16-18H,6-7,12-15H2,1-3H3,(H,23,25,26)