2-[3-(3-methoxyphenyl)piperazin-1-yl]-3-methyl-6-pyrimidin-4-yl-pyrimidin-4-one

Systemtic Name: 2-[3-(3-methoxyphenyl)piperazin-1-yl]-3-methyl-6-pyrimidin-4-yl-pyrimidin-4-one Openeye Name: 2-[3-(3-methoxyphenyl)piperazin-1-yl]-3-methyl-6-pyrimidin-4-yl-pyrimidin-4-one CAS Name: 2-[3-(3-methoxyphenyl)-1-piperazinyl]-3-methyl-6-(4-pyrimidinyl)-4-pyrimidinone IUPAC Name: 2-[3-(3-methoxyphenyl)piperazin-1-yl]-3-methyl-6-pyrimidin-4-ylpyrimidin-4-one Traditional Name: 2-[3-(3-methoxyphenyl)piperazino]-3-methyl-6-(4-pyrimidyl)pyrimidin-4-one Formula: C20H22N6O2 MolecularWeight: 378.42768

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(N=C1N2CCNC(C2)C3=CC(=CC=C3)OC)C4=NC=NC=C4

Isomeric SMILES

CN1C(=O)C=C(N=C1N2CCNC(C2)C3=CC(=CC=C3)OC)C4=NC=NC=C4

InChI

InChI=1S/C20H22N6O2/c1-25-19(27)11-17(16-6-7-21-13-23-16)24-20(25)26-9-8-22-18(12-26)14-4-3-5-15(10-14)28-2/h3-7,10-11,13,18,22H,8-9,12H2,1-2H3