N-(6,7-dimethoxy-4-oxidanylidene-2-thiophen-2-yl-quinazolin-3-yl)-2,6-bis(fluoranyl)benzamide

Systemtic Name: N-(6,7-dimethoxy-4-oxidanylidene-2-thiophen-2-yl-quinazolin-3-yl)-2,6-bis(fluoranyl)benzamide Openeye Name: N-[6,7-dimethoxy-4-oxo-2-(2-thienyl)quinazolin-3-yl]-2,6-difluoro-benzamide CAS Name: N-(6,7-dimethoxy-4-oxo-2-thiophen-2-yl-3-quinazolinyl)-2,6-difluorobenzamide IUPAC Name: N-(6,7-dimethoxy-4-oxo-2-thiophen-2-ylquinazolin-3-yl)-2,6-difluorobenzamide Traditional Name: 2,6-difluoro-N-[4-keto-6,7-dimethoxy-2-(2-thienyl)quinazolin-3-yl]benzamide Formula: C21H15F2N3O4S MolecularWeight: 443.423306

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N(C(=N2)C3=CC=CS3)NC(=O)C4=C(C=CC=C4F)F)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N(C(=N2)C3=CC=CS3)NC(=O)C4=C(C=CC=C4F)F)OC

InChI

InChI=1S/C21H15F2N3O4S/c1-29-15-9-11-14(10-16(15)30-2)24-19(17-7-4-8-31-17)26(21(11)28)25-20(27)18-12(22)5-3-6-13(18)23/h3-10H,1-2H3,(H,25,27)