(2R)-2-(4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-N-[4-(trifluoromethyl)phenyl]propanamide

Systemtic Name: (2R)-2-(4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-N-[4-(trifluoromethyl)phenyl]propanamide Openeye Name: (2R)-2-(3-isopropyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[4-(trifluoromethyl)phenyl]propanamide CAS Name: (2R)-2-[(4-oxo-3-propan-2-yl-2-quinazolinyl)thio]-N-[4-(trifluoromethyl)phenyl]propanamide IUPAC Name: (2R)-2-(4-oxo-3-propan-2-ylquinazolin-2-yl)sulfanyl-N-[4-(trifluoromethyl)phenyl]propanamide Traditional Name: (2R)-2-[(3-isopropyl-4-keto-quinazolin-2-yl)thio]-N-[4-(trifluoromethyl)phenyl]propionamide Formula: C21H20F3N3O2S MolecularWeight: 435.46261

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)C(F)(F)F)SC2=NC3=CC=CC=C3C(=O)N2C(C)C

InChI

InChI=1S/C21H20F3N3O2S/c1-12(2)27-19(29)16-6-4-5-7-17(16)26-20(27)30-13(3)18(28)25-15-10-8-14(9-11-15)21(22,23)24/h4-13H,1-3H3,(H,25,28)/t13-/m1/s1