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

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-3-ethyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-3-ethyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-(4-bromo-3-methylphenyl)-3-ethyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(4-bromo-3-methylphenyl)-3-ethyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-3-ethyl-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C18H16BrN3O2S MolecularWeight: 418.30754

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)Br)C)NC1=S

Isomeric SMILES

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

InChI

InChI=1S/C18H16BrN3O2S/c1-3-22-17(24)13-6-4-11(9-15(13)21-18(22)25)16(23)20-12-5-7-14(19)10(2)8-12/h4-9H,3H2,1-2H3,(H,20,23)(H,21,25)