(4S)-5-chloranyl-4-(2-cyclopropylethynyl)-4-(trifluoromethyl)-1,3-dihydroquinazolin-2-one

Systemtic Name: (4S)-5-chloranyl-4-(2-cyclopropylethynyl)-4-(trifluoromethyl)-1,3-dihydroquinazolin-2-one Openeye Name: (4S)-5-chloro-4-(2-cyclopropylethynyl)-4-(trifluoromethyl)-1,3-dihydroquinazolin-2-one CAS Name: (4S)-5-chloro-4-(2-cyclopropylethynyl)-4-(trifluoromethyl)-1,3-dihydroquinazolin-2-one IUPAC Name: (4S)-5-chloro-4-(2-cyclopropylethynyl)-4-(trifluoromethyl)-1,3-dihydroquinazolin-2-one Traditional Name: (4S)-5-chloro-4-(2-cyclopropylethynyl)-4-(trifluoromethyl)-1,3-dihydroquinazolin-2-one Formula: C14H10ClF3N2O MolecularWeight: 314.69021

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C#CC2(C3=C(C=CC=C3Cl)NC(=O)N2)C(F)(F)F

Isomeric SMILES

C1CC1C#C[C@]2(C3=C(C=CC=C3Cl)NC(=O)N2)C(F)(F)F

InChI

InChI=1S/C14H10ClF3N2O/c15-9-2-1-3-10-11(9)13(14(16,17)18,20-12(21)19-10)7-6-8-4-5-8/h1-3,8H,4-5H2,(H2,19,20,21)/t13-/m0/s1