4-[4-(4-methylsulfonylphenyl)-1-prop-2-enyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine

Systemtic Name: 4-[4-(4-methylsulfonylphenyl)-1-prop-2-enyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine Openeye Name: 4-[1-allyl-4-(4-methylsulfonylphenyl)-5-(trifluoromethyl)pyrazol-3-yl]pyridine CAS Name: 4-[4-(4-methylsulfonylphenyl)-1-prop-2-enyl-5-(trifluoromethyl)-3-pyrazolyl]pyridine IUPAC Name: 4-[4-(4-methylsulfonylphenyl)-1-prop-2-enyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine Traditional Name: 4-[1-allyl-4-(4-mesylphenyl)-5-(trifluoromethyl)pyrazol-3-yl]pyridine Formula: C19H16F3N3O2S MolecularWeight: 407.40945

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(N(N=C2C3=CC=NC=C3)CC=C)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(N(N=C2C3=CC=NC=C3)CC=C)C(F)(F)F

InChI

InChI=1S/C19H16F3N3O2S/c1-3-12-25-18(19(20,21)22)16(17(24-25)14-8-10-23-11-9-14)13-4-6-15(7-5-13)28(2,26)27/h3-11H,1,12H2,2H3