N-(3,5-dimethoxyphenyl)-3-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(3,5-dimethoxyphenyl)-3-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-(3,5-dimethoxyphenyl)-3-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-(3,5-dimethoxyphenyl)-3-[(4-oxo-3-phenyl-2-quinazolinyl)thio]propanamide IUPAC Name: N-(3,5-dimethoxyphenyl)-3-(4-oxo-3-phenylquinazolin-2-yl)sulfanylpropanamide Traditional Name: N-(3,5-dimethoxyphenyl)-3-[(4-keto-3-phenyl-quinazolin-2-yl)thio]propionamide Formula: C25H23N3O4S MolecularWeight: 461.53282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)CCSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)CCSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4)OC

InChI

InChI=1S/C25H23N3O4S/c1-31-19-14-17(15-20(16-19)32-2)26-23(29)12-13-33-25-27-22-11-7-6-10-21(22)24(30)28(25)18-8-4-3-5-9-18/h3-11,14-16H,12-13H2,1-2H3,(H,26,29)