2-[3,5-dimethyl-1-(4-methylphenyl)sulfonyl-pyrazol-4-yl]sulfanyl-5-(trifluoromethyl)pyridine

Systemtic Name: 2-[3,5-dimethyl-1-(4-methylphenyl)sulfonyl-pyrazol-4-yl]sulfanyl-5-(trifluoromethyl)pyridine Openeye Name: 2-[3,5-dimethyl-1-(p-tolylsulfonyl)pyrazol-4-yl]sulfanyl-5-(trifluoromethyl)pyridine CAS Name: 2-[[3,5-dimethyl-1-(4-methylphenyl)sulfonyl-4-pyrazolyl]thio]-5-(trifluoromethyl)pyridine IUPAC Name: 2-[3,5-dimethyl-1-(4-methylphenyl)sulfonylpyrazol-4-yl]sulfanyl-5-(trifluoromethyl)pyridine Traditional Name: 2-[(3,5-dimethyl-1-tosyl-pyrazol-4-yl)thio]-5-(trifluoromethyl)pyridine Formula: C18H16F3N3O2S2 MolecularWeight: 427.46375

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(=C(C(=N2)C)SC3=NC=C(C=C3)C(F)(F)F)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(=C(C(=N2)C)SC3=NC=C(C=C3)C(F)(F)F)C

InChI

InChI=1S/C18H16F3N3O2S2/c1-11-4-7-15(8-5-11)28(25,26)24-13(3)17(12(2)23-24)27-16-9-6-14(10-22-16)18(19,20)21/h4-10H,1-3H3