(2S)-2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(3-fluoranyl-4-methyl-phenyl)propanamide

Systemtic Name: (2S)-2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(3-fluoranyl-4-methyl-phenyl)propanamide Openeye Name: (2S)-2-(3-ethyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(3-fluoro-4-methyl-phenyl)propanamide CAS Name: (2S)-2-[(3-ethyl-4-oxo-2-quinazolinyl)thio]-N-(3-fluoro-4-methylphenyl)propanamide IUPAC Name: (2S)-2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanyl-N-(3-fluoro-4-methylphenyl)propanamide Traditional Name: (2S)-2-[(3-ethyl-4-keto-quinazolin-2-yl)thio]-N-(3-fluoro-4-methyl-phenyl)propionamide Formula: C20H20FN3O2S MolecularWeight: 385.455103

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=CC(=C(C=C3)C)F

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1S[C@@H](C)C(=O)NC3=CC(=C(C=C3)C)F

InChI

InChI=1S/C20H20FN3O2S/c1-4-24-19(26)15-7-5-6-8-17(15)23-20(24)27-13(3)18(25)22-14-10-9-12(2)16(21)11-14/h5-11,13H,4H2,1-3H3,(H,22,25)/t13-/m0/s1