6,7-dimethoxy-2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1H-quinazolin-4-one

Systemtic Name: 6,7-dimethoxy-2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1H-quinazolin-4-one Openeye Name: 6,7-dimethoxy-2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1H-quinazolin-4-one CAS Name: 6,7-dimethoxy-2-[[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-1H-quinazolin-4-one IUPAC Name: 6,7-dimethoxy-2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1H-quinazolin-4-one Traditional Name: 6,7-dimethoxy-2-[[4-(2-pyrimidyl)piperazino]methyl]-1H-quinazolin-4-one Formula: C19H22N6O3 MolecularWeight: 382.41638

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N=C(N2)CN3CCN(CC3)C4=NC=CC=N4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N=C(N2)CN3CCN(CC3)C4=NC=CC=N4)OC

InChI

InChI=1S/C19H22N6O3/c1-27-15-10-13-14(11-16(15)28-2)22-17(23-18(13)26)12-24-6-8-25(9-7-24)19-20-4-3-5-21-19/h3-5,10-11H,6-9,12H2,1-2H3,(H,22,23,26)