3-methyl-2-(4-oxidanylidene-2-phenyl-quinazolin-3-yl)-N-(phenylcarbamothioyl)butanamide

Systemtic Name: 3-methyl-2-(4-oxidanylidene-2-phenyl-quinazolin-3-yl)-N-(phenylcarbamothioyl)butanamide Openeye Name: 3-methyl-2-(4-oxo-2-phenyl-quinazolin-3-yl)-N-(phenylcarbamothioyl)butanamide CAS Name: N-[anilino(sulfanylidene)methyl]-3-methyl-2-(4-oxo-2-phenyl-3-quinazolinyl)butanamide IUPAC Name: 3-methyl-2-(4-oxo-2-phenylquinazolin-3-yl)-N-(phenylcarbamothioyl)butanamide Traditional Name: 2-(4-keto-2-phenyl-quinazolin-3-yl)-3-methyl-N-(phenylthiocarbamoyl)butyramide Formula: C26H24N4O2S MolecularWeight: 456.55936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=S)NC1=CC=CC=C1)N2C(=NC3=CC=CC=C3C2=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)C(C(=O)NC(=S)NC1=CC=CC=C1)N2C(=NC3=CC=CC=C3C2=O)C4=CC=CC=C4

InChI

InChI=1S/C26H24N4O2S/c1-17(2)22(24(31)29-26(33)27-19-13-7-4-8-14-19)30-23(18-11-5-3-6-12-18)28-21-16-10-9-15-20(21)25(30)32/h3-17,22H,1-2H3,(H2,27,29,31,33)