N-(2,5-dimethylphenyl)-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-(2,5-dimethylphenyl)-2-(3-methyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-(2,5-dimethylphenyl)-2-[(3-methyl-4-oxo-2-quinazolinyl)thio]propanamide IUPAC Name: N-(2,5-dimethylphenyl)-2-(3-methyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: N-(2,5-dimethylphenyl)-2-[(4-keto-3-methyl-quinazolin-2-yl)thio]propionamide Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C

InChI

InChI=1S/C20H21N3O2S/c1-12-9-10-13(2)17(11-12)21-18(24)14(3)26-20-22-16-8-6-5-7-15(16)19(25)23(20)4/h5-11,14H,1-4H3,(H,21,24)