2-[5-(3-methylbutyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-5-methylsulfonyl-pyridine

Systemtic Name: 2-[5-(3-methylbutyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-5-methylsulfonyl-pyridine Openeye Name: 2-[5-isopentyl-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-5-methylsulfonyl-pyridine CAS Name: 2-[5-(3-methylbutyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-5-methylsulfonylpyridine IUPAC Name: 2-[5-(3-methylbutyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-5-methylsulfonylpyridine Traditional Name: 2-[5-isoamyl-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-5-mesyl-pyridine Formula: C14H17F3N4O2S MolecularWeight: 362.37059

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=NC(=NN1C2=NC=C(C=C2)S(=O)(=O)C)C(F)(F)F

Isomeric SMILES

CC(C)CCC1=NC(=NN1C2=NC=C(C=C2)S(=O)(=O)C)C(F)(F)F

InChI

InChI=1S/C14H17F3N4O2S/c1-9(2)4-6-12-19-13(14(15,16)17)20-21(12)11-7-5-10(8-18-11)24(3,22)23/h5,7-9H,4,6H2,1-3H3