3-(3,4-dimethoxyphenyl)-2-(4-oxidanylidene-4-phenyl-butyl)sulfanyl-quinazolin-4-one

Systemtic Name: 3-(3,4-dimethoxyphenyl)-2-(4-oxidanylidene-4-phenyl-butyl)sulfanyl-quinazolin-4-one Openeye Name: 3-(3,4-dimethoxyphenyl)-2-(4-oxo-4-phenyl-butyl)sulfanyl-quinazolin-4-one CAS Name: 3-(3,4-dimethoxyphenyl)-2-[(4-oxo-4-phenylbutyl)thio]-4-quinazolinone IUPAC Name: 3-(3,4-dimethoxyphenyl)-2-(4-oxo-4-phenylbutyl)sulfanylquinazolin-4-one Traditional Name: 3-(3,4-dimethoxyphenyl)-2-[(4-keto-4-phenyl-butyl)thio]quinazolin-4-one Formula: C26H24N2O4S MolecularWeight: 460.54476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCCCC(=O)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCCCC(=O)C4=CC=CC=C4)OC

InChI

InChI=1S/C26H24N2O4S/c1-31-23-15-14-19(17-24(23)32-2)28-25(30)20-11-6-7-12-21(20)27-26(28)33-16-8-13-22(29)18-9-4-3-5-10-18/h3-7,9-12,14-15,17H,8,13,16H2,1-2H3