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

Systemtic Name: N-(2,4-dimethylphenyl)-2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-(2,4-dimethylphenyl)-2-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-(2,4-dimethylphenyl)-2-[(4-oxo-3-phenyl-2-quinazolinyl)thio]propanamide IUPAC Name: N-(2,4-dimethylphenyl)-2-(4-oxo-3-phenylquinazolin-2-yl)sulfanylpropanamide Traditional Name: N-(2,4-dimethylphenyl)-2-[(4-keto-3-phenyl-quinazolin-2-yl)thio]propionamide Formula: C25H23N3O2S MolecularWeight: 429.53402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4)C

InChI

InChI=1S/C25H23N3O2S/c1-16-13-14-21(17(2)15-16)26-23(29)18(3)31-25-27-22-12-8-7-11-20(22)24(30)28(25)19-9-5-4-6-10-19/h4-15,18H,1-3H3,(H,26,29)