(5-cyclopropyl-1,2-oxazol-4-yl)-[2-phenylsulfanyl-4-(trifluoromethyl)phenyl]methanone

Systemtic Name: (5-cyclopropyl-1,2-oxazol-4-yl)-[2-phenylsulfanyl-4-(trifluoromethyl)phenyl]methanone Openeye Name: (5-cyclopropylisoxazol-4-yl)-[2-phenylsulfanyl-4-(trifluoromethyl)phenyl]methanone CAS Name: (5-cyclopropyl-4-isoxazolyl)-[2-(phenylthio)-4-(trifluoromethyl)phenyl]methanone IUPAC Name: (5-cyclopropyl-1,2-oxazol-4-yl)-[2-phenylsulfanyl-4-(trifluoromethyl)phenyl]methanone Traditional Name: (5-cyclopropylisoxazol-4-yl)-[2-(phenylthio)-4-(trifluoromethyl)phenyl]methanone Formula: C20H14F3NO2S MolecularWeight: 389.39087

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=C(C=NO2)C(=O)C3=C(C=C(C=C3)C(F)(F)F)SC4=CC=CC=C4

Isomeric SMILES

C1CC1C2=C(C=NO2)C(=O)C3=C(C=C(C=C3)C(F)(F)F)SC4=CC=CC=C4

InChI

InChI=1S/C20H14F3NO2S/c21-20(22,23)13-8-9-15(17(10-13)27-14-4-2-1-3-5-14)18(25)16-11-24-26-19(16)12-6-7-12/h1-5,8-12H,6-7H2