3-(4,6-dimethoxypyrimidin-2-yl)-1-[4-(diphenylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(4,6-dimethoxypyrimidin-2-yl)-1-[4-(diphenylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-3-(4,6-dimethoxypyrimidin-2-yl)propan-1-one CAS Name: 3-(4,6-dimethoxy-2-pyrimidinyl)-1-[4-(diphenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-3-(4,6-dimethoxypyrimidin-2-yl)propan-1-one Traditional Name: 1-(4-benzhydrylpiperazino)-3-(4,6-dimethoxypyrimidin-2-yl)propan-1-one Formula: C26H30N4O3 MolecularWeight: 446.5414

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)CCC(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC(=NC(=N1)CCC(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)OC

InChI

InChI=1S/C26H30N4O3/c1-32-23-19-24(33-2)28-22(27-23)13-14-25(31)29-15-17-30(18-16-29)26(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-12,19,26H,13-18H2,1-2H3