3-ethyl-N-(3-fluoranyl-4-methyl-phenyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 3-ethyl-N-(3-fluoranyl-4-methyl-phenyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-ethyl-N-(3-fluoro-4-methyl-phenyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-ethyl-N-(3-fluoro-4-methylphenyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 3-ethyl-N-(3-fluoro-4-methylphenyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-ethyl-N-(3-fluoro-4-methyl-phenyl)-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C18H16FN3O2S MolecularWeight: 357.401943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3)C)F)NC1=S

Isomeric SMILES

CCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3)C)F)NC1=S

InChI

InChI=1S/C18H16FN3O2S/c1-3-22-17(24)13-7-5-11(8-15(13)21-18(22)25)16(23)20-12-6-4-10(2)14(19)9-12/h4-9H,3H2,1-2H3,(H,20,23)(H,21,25)