3-[2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-6-(4-ethoxyphenyl)pyrimidin-4-one

Systemtic Name: 3-[2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-6-(4-ethoxyphenyl)pyrimidin-4-one Openeye Name: 3-[2-(4-benzhydrylpiperazin-1-yl)-2-oxo-ethyl]-6-(4-ethoxyphenyl)pyrimidin-4-one CAS Name: 3-[2-[4-(diphenylmethyl)-1-piperazinyl]-2-oxoethyl]-6-(4-ethoxyphenyl)-4-pyrimidinone IUPAC Name: 3-[2-(4-benzhydrylpiperazin-1-yl)-2-oxoethyl]-6-(4-ethoxyphenyl)pyrimidin-4-one Traditional Name: 3-[2-(4-benzhydrylpiperazino)-2-keto-ethyl]-6-p-phenetyl-pyrimidin-4-one Formula: C31H32N4O3 MolecularWeight: 508.61078

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CC(=O)N(C=N2)CC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CC(=O)N(C=N2)CC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H32N4O3/c1-2-38-27-15-13-24(14-16-27)28-21-29(36)35(23-32-28)22-30(37)33-17-19-34(20-18-33)31(25-9-5-3-6-10-25)26-11-7-4-8-12-26/h3-16,21,23,31H,2,17-20,22H2,1H3