3-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-1H-pyridazin-6-one

Systemtic Name: 3-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-1H-pyridazin-6-one Openeye Name: 3-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-1H-pyridazin-6-one CAS Name: 3-[4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-1H-pyridazin-6-one IUPAC Name: 3-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-1H-pyridazin-6-one Traditional Name: 3-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazino]-1H-pyridazin-6-one Formula: C18H21N7O3 MolecularWeight: 383.40444

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C4=NNC(=O)C=C4)N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C4=NNC(=O)C=C4)N)OC

InChI

InChI=1S/C18H21N7O3/c1-27-13-9-11-12(10-14(13)28-2)20-18(21-17(11)19)25-7-5-24(6-8-25)15-3-4-16(26)23-22-15/h3-4,9-10H,5-8H2,1-2H3,(H,23,26)(H2,19,20,21)