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

Systemtic Name: N-(2,5-dimethoxyphenyl)-3-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-(2,5-dimethoxyphenyl)-3-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-(2,5-dimethoxyphenyl)-3-[(4-oxo-3-phenyl-2-quinazolinyl)thio]propanamide IUPAC Name: N-(2,5-dimethoxyphenyl)-3-(4-oxo-3-phenylquinazolin-2-yl)sulfanylpropanamide Traditional Name: N-(2,5-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(=C(C=C1)OC)NC(=O)CCSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

Isomeric SMILES

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

InChI

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