N-[4-(6,7-dimethoxyquinazolin-4-yl)sulfanyl-2-fluoranyl-phenyl]-1-(4-fluorophenyl)-2-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: N-[4-(6,7-dimethoxyquinazolin-4-yl)sulfanyl-2-fluoranyl-phenyl]-1-(4-fluorophenyl)-2-oxidanylidene-pyridine-3-carboxamide Openeye Name: N-[4-(6,7-dimethoxyquinazolin-4-yl)sulfanyl-2-fluoro-phenyl]-1-(4-fluorophenyl)-2-oxo-pyridine-3-carboxamide CAS Name: N-[4-[(6,7-dimethoxy-4-quinazolinyl)thio]-2-fluorophenyl]-1-(4-fluorophenyl)-2-oxo-3-pyridinecarboxamide IUPAC Name: N-[4-(6,7-dimethoxyquinazolin-4-yl)sulfanyl-2-fluorophenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide Traditional Name: N-[4-[(6,7-dimethoxyquinazolin-4-yl)thio]-2-fluoro-phenyl]-1-(4-fluorophenyl)-2-keto-nicotinamide Formula: C28H20F2N4O4S MolecularWeight: 546.544606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)SC3=CC(=C(C=C3)NC(=O)C4=CC=CN(C4=O)C5=CC=C(C=C5)F)F)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)SC3=CC(=C(C=C3)NC(=O)C4=CC=CN(C4=O)C5=CC=C(C=C5)F)F)OC

InChI

InChI=1S/C28H20F2N4O4S/c1-37-24-13-20-23(14-25(24)38-2)31-15-32-27(20)39-18-9-10-22(21(30)12-18)33-26(35)19-4-3-11-34(28(19)36)17-7-5-16(29)6-8-17/h3-15H,1-2H3,(H,33,35)