3-methylsulfanyl-4-propan-2-yl-5-(trifluoromethyl)-1,2,4-triazole

Systemtic Name: 3-methylsulfanyl-4-propan-2-yl-5-(trifluoromethyl)-1,2,4-triazole Openeye Name: 4-isopropyl-3-methylsulfanyl-5-(trifluoromethyl)-1,2,4-triazole CAS Name: 3-(methylthio)-4-propan-2-yl-5-(trifluoromethyl)-1,2,4-triazole IUPAC Name: 3-methylsulfanyl-4-propan-2-yl-5-(trifluoromethyl)-1,2,4-triazole Traditional Name: 4-isopropyl-3-(methylthio)-5-(trifluoromethyl)-1,2,4-triazole Formula: C7H10F3N3S MolecularWeight: 225.23461

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=NN=C1SC)C(F)(F)F

Isomeric SMILES

CC(C)N1C(=NN=C1SC)C(F)(F)F

InChI

InChI=1S/C7H10F3N3S/c1-4(2)13-5(7(8,9)10)11-12-6(13)14-3/h4H,1-3H3