[1-(4,6-dimethoxypyrimidin-2-yl)piperidin-4-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: [1-(4,6-dimethoxypyrimidin-2-yl)piperidin-4-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[1-(4,6-dimethoxypyrimidin-2-yl)-4-piperidyl]methanone CAS Name: [1-(4,6-dimethoxy-2-pyrimidinyl)-4-piperidinyl]-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-[1-(4,6-dimethoxypyrimidin-2-yl)piperidin-4-yl]methanone Traditional Name: (4-benzylpiperazino)-[1-(4,6-dimethoxypyrimidin-2-yl)-4-piperidyl]methanone Formula: C23H31N5O3 MolecularWeight: 425.52394

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)N2CCC(CC2)C(=O)N3CCN(CC3)CC4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC(=NC(=N1)N2CCC(CC2)C(=O)N3CCN(CC3)CC4=CC=CC=C4)OC

InChI

InChI=1S/C23H31N5O3/c1-30-20-16-21(31-2)25-23(24-20)28-10-8-19(9-11-28)22(29)27-14-12-26(13-15-27)17-18-6-4-3-5-7-18/h3-7,16,19H,8-15,17H2,1-2H3