4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)-N-(3,4-dichlorophenyl)piperazine-1-carboxamide

Systemtic Name: 4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)-N-(3,4-dichlorophenyl)piperazine-1-carboxamide Openeye Name: 4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-N-(3,4-dichlorophenyl)piperazine-1-carboxamide CAS Name: 4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-N-(3,4-dichlorophenyl)-1-piperazinecarboxamide IUPAC Name: 4-(4-amino-6,7-dimethoxyquinazolin-2-yl)-N-(3,4-dichlorophenyl)piperazine-1-carboxamide Traditional Name: 4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-N-(3,4-dichlorophenyl)piperazine-1-carboxamide Formula: C21H22Cl2N6O3 MolecularWeight: 477.34378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)NC4=CC(=C(C=C4)Cl)Cl)N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)NC4=CC(=C(C=C4)Cl)Cl)N)OC

InChI

InChI=1S/C21H22Cl2N6O3/c1-31-17-10-13-16(11-18(17)32-2)26-20(27-19(13)24)28-5-7-29(8-6-28)21(30)25-12-3-4-14(22)15(23)9-12/h3-4,9-11H,5-8H2,1-2H3,(H,25,30)(H2,24,26,27)