benzene; 1-(3-fluoranyl-4-methylsulfanyl-phenyl)-3-(trifluoromethyl)-1,2,4-triazole

Systemtic Name: benzene; 1-(3-fluoranyl-4-methylsulfanyl-phenyl)-3-(trifluoromethyl)-1,2,4-triazole Openeye Name: benzene; 1-(3-fluoro-4-methylsulfanyl-phenyl)-3-(trifluoromethyl)-1,2,4-triazole CAS Name: benzene; 1-[3-fluoro-4-(methylthio)phenyl]-3-(trifluoromethyl)-1,2,4-triazole IUPAC Name: benzene; 1-(3-fluoro-4-methylsulfanylphenyl)-3-(trifluoromethyl)-1,2,4-triazole Traditional Name: benzene; 1-[3-fluoro-4-(methylthio)phenyl]-3-(trifluoromethyl)-1,2,4-triazole Formula: C16H13F4N3S MolecularWeight: 355.353133

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)N2C=NC(=N2)C(F)(F)F)F.C1=CC=CC=C1

Isomeric SMILES

CSC1=C(C=C(C=C1)N2C=NC(=N2)C(F)(F)F)F.C1=CC=CC=C1

InChI

InChI=1S/C10H7F4N3S.C6H6/c1-18-8-3-2-6(4-7(8)11)17-5-15-9(16-17)10(12,13)14;1-2-4-6-5-3-1/h2-5H,1H3;1-6H