2-phenyl-3-propan-2-yl-5,5-bis(trifluoromethyl)-1H-1,2,4-triazole

Systemtic Name: 2-phenyl-3-propan-2-yl-5,5-bis(trifluoromethyl)-1H-1,2,4-triazole Openeye Name: 3-isopropyl-2-phenyl-5,5-bis(trifluoromethyl)-1H-1,2,4-triazole CAS Name: 2-phenyl-3-propan-2-yl-5,5-bis(trifluoromethyl)-1H-1,2,4-triazole IUPAC Name: 2-phenyl-3-propan-2-yl-5,5-bis(trifluoromethyl)-1H-1,2,4-triazole Traditional Name: 3-isopropyl-2-phenyl-5,5-bis(trifluoromethyl)-1H-1,2,4-triazole Formula: C13H13F6N3 MolecularWeight: 325.252839

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(NN1C2=CC=CC=C2)(C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC(C)C1=NC(NN1C2=CC=CC=C2)(C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C13H13F6N3/c1-8(2)10-20-11(12(14,15)16,13(17,18)19)21-22(10)9-6-4-3-5-7-9/h3-8,21H,1-2H3