5-[5-(3,4-dimethylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]-2-methylsulfonyl-pyridine

Systemtic Name: 5-[5-(3,4-dimethylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]-2-methylsulfonyl-pyridine Openeye Name: 5-[5-(3,4-dimethylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]-2-methylsulfonyl-pyridine CAS Name: 5-[5-(3,4-dimethylphenyl)-3-(trifluoromethyl)-1-pyrazolyl]-2-methylsulfonylpyridine IUPAC Name: 5-[5-(3,4-dimethylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]-2-methylsulfonylpyridine Traditional Name: 5-[5-(3,4-dimethylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]-2-mesyl-pyridine Formula: C18H16F3N3O2S MolecularWeight: 395.39875

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC(=NN2C3=CN=C(C=C3)S(=O)(=O)C)C(F)(F)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC(=NN2C3=CN=C(C=C3)S(=O)(=O)C)C(F)(F)F)C

InChI

InChI=1S/C18H16F3N3O2S/c1-11-4-5-13(8-12(11)2)15-9-16(18(19,20)21)23-24(15)14-6-7-17(22-10-14)27(3,25)26/h4-10H,1-3H3