6,7-dimethoxy-3-[2-oxidanylidene-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]quinazolin-4-one

Systemtic Name: 6,7-dimethoxy-3-[2-oxidanylidene-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]quinazolin-4-one Openeye Name: 6,7-dimethoxy-3-[2-oxo-2-[4-(2-pyridyl)piperazin-1-yl]ethyl]quinazolin-4-one CAS Name: 6,7-dimethoxy-3-[2-oxo-2-[4-(2-pyridinyl)-1-piperazinyl]ethyl]-4-quinazolinone IUPAC Name: 6,7-dimethoxy-3-[2-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]quinazolin-4-one Traditional Name: 3-[2-keto-2-[4-(2-pyridyl)piperazino]ethyl]-6,7-dimethoxy-quinazolin-4-one Formula: C21H23N5O4 MolecularWeight: 409.43842

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N(C=N2)CC(=O)N3CCN(CC3)C4=CC=CC=N4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N(C=N2)CC(=O)N3CCN(CC3)C4=CC=CC=N4)OC

InChI

InChI=1S/C21H23N5O4/c1-29-17-11-15-16(12-18(17)30-2)23-14-26(21(15)28)13-20(27)25-9-7-24(8-10-25)19-5-3-4-6-22-19/h3-6,11-12,14H,7-10,13H2,1-2H3