(4S)-4-(2-cyclopropylethynyl)-6-methoxy-4-(trifluoromethyl)-1,3-dihydroquinazolin-2-one

Systemtic Name: (4S)-4-(2-cyclopropylethynyl)-6-methoxy-4-(trifluoromethyl)-1,3-dihydroquinazolin-2-one Openeye Name: (4S)-4-(2-cyclopropylethynyl)-6-methoxy-4-(trifluoromethyl)-1,3-dihydroquinazolin-2-one CAS Name: (4S)-4-(2-cyclopropylethynyl)-6-methoxy-4-(trifluoromethyl)-1,3-dihydroquinazolin-2-one IUPAC Name: (4S)-4-(2-cyclopropylethynyl)-6-methoxy-4-(trifluoromethyl)-1,3-dihydroquinazolin-2-one Traditional Name: (4S)-4-(2-cyclopropylethynyl)-6-methoxy-4-(trifluoromethyl)-1,3-dihydroquinazolin-2-one Formula: C15H13F3N2O2 MolecularWeight: 310.27113

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC(=O)NC2(C#CC3CC3)C(F)(F)F

Isomeric SMILES

COC1=CC2=C(C=C1)NC(=O)N[C@]2(C#CC3CC3)C(F)(F)F

InChI

InChI=1S/C15H13F3N2O2/c1-22-10-4-5-12-11(8-10)14(15(16,17)18,20-13(21)19-12)7-6-9-2-3-9/h4-5,8-9H,2-3H2,1H3,(H2,19,20,21)/t14-/m0/s1