N-[3,4-bis(fluoranyl)phenyl]-3-(2,3-dimethylphenyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[3,4-bis(fluoranyl)phenyl]-3-(2,3-dimethylphenyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-(3,4-difluorophenyl)-3-(2,3-dimethylphenyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-(3,4-difluorophenyl)-3-(2,3-dimethylphenyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(3,4-difluorophenyl)-3-(2,3-dimethylphenyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-(3,4-difluorophenyl)-3-(2,3-dimethylphenyl)-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C23H17F2N3O2S MolecularWeight: 437.461786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)NC4=CC(=C(C=C4)F)F)NC2=S)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)NC4=CC(=C(C=C4)F)F)NC2=S)C

InChI

InChI=1S/C23H17F2N3O2S/c1-12-4-3-5-20(13(12)2)28-22(30)16-8-6-14(10-19(16)27-23(28)31)21(29)26-15-7-9-17(24)18(25)11-15/h3-11H,1-2H3,(H,26,29)(H,27,31)