4-(6,7-dimethoxyquinazolin-4-yl)-N-(3-fluoranyl-4-methyl-phenyl)piperazine-1-carboxamide

Systemtic Name: 4-(6,7-dimethoxyquinazolin-4-yl)-N-(3-fluoranyl-4-methyl-phenyl)piperazine-1-carboxamide Openeye Name: 4-(6,7-dimethoxyquinazolin-4-yl)-N-(3-fluoro-4-methyl-phenyl)piperazine-1-carboxamide CAS Name: 4-(6,7-dimethoxy-4-quinazolinyl)-N-(3-fluoro-4-methylphenyl)-1-piperazinecarboxamide IUPAC Name: 4-(6,7-dimethoxyquinazolin-4-yl)-N-(3-fluoro-4-methylphenyl)piperazine-1-carboxamide Traditional Name: 4-(6,7-dimethoxyquinazolin-4-yl)-N-(3-fluoro-4-methyl-phenyl)piperazine-1-carboxamide Formula: C22H24FN5O3 MolecularWeight: 425.456063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)N2CCN(CC2)C3=NC=NC4=CC(=C(C=C43)OC)OC)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)N2CCN(CC2)C3=NC=NC4=CC(=C(C=C43)OC)OC)F

InChI

InChI=1S/C22H24FN5O3/c1-14-4-5-15(10-17(14)23)26-22(29)28-8-6-27(7-9-28)21-16-11-19(30-2)20(31-3)12-18(16)24-13-25-21/h4-5,10-13H,6-9H2,1-3H3,(H,26,29)