N-(3,5-dimethylphenyl)-2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-butanamide

Systemtic Name: N-(3,5-dimethylphenyl)-2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-butanamide Openeye Name: N-(3,5-dimethylphenyl)-2-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanyl-butanamide CAS Name: N-(3,5-dimethylphenyl)-2-[(4-oxo-3-phenyl-2-quinazolinyl)thio]butanamide IUPAC Name: N-(3,5-dimethylphenyl)-2-(4-oxo-3-phenylquinazolin-2-yl)sulfanylbutanamide Traditional Name: N-(3,5-dimethylphenyl)-2-[(4-keto-3-phenyl-quinazolin-2-yl)thio]butyramide Formula: C26H25N3O2S MolecularWeight: 443.5606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=CC(=C1)C)C)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

Isomeric SMILES

CCC(C(=O)NC1=CC(=CC(=C1)C)C)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

InChI

InChI=1S/C26H25N3O2S/c1-4-23(24(30)27-19-15-17(2)14-18(3)16-19)32-26-28-22-13-9-8-12-21(22)25(31)29(26)20-10-6-5-7-11-20/h5-16,23H,4H2,1-3H3,(H,27,30)