2-[3-ethyl-5-(4-methylsulfonylphenyl)cyclopenta-1,4-dien-1-yl]-5-(trifluoromethyl)pyridine

Systemtic Name: 2-[3-ethyl-5-(4-methylsulfonylphenyl)cyclopenta-1,4-dien-1-yl]-5-(trifluoromethyl)pyridine Openeye Name: 2-[3-ethyl-5-(4-methylsulfonylphenyl)cyclopenta-1,4-dien-1-yl]-5-(trifluoromethyl)pyridine CAS Name: 2-[3-ethyl-5-(4-methylsulfonylphenyl)-1-cyclopenta-1,4-dienyl]-5-(trifluoromethyl)pyridine IUPAC Name: 2-[3-ethyl-5-(4-methylsulfonylphenyl)cyclopenta-1,4-dien-1-yl]-5-(trifluoromethyl)pyridine Traditional Name: 2-[3-ethyl-5-(4-mesylphenyl)cyclopenta-1,4-dien-1-yl]-5-(trifluoromethyl)pyridine Formula: C20H18F3NO2S MolecularWeight: 393.42263

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C=C(C(=C1)C2=NC=C(C=C2)C(F)(F)F)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCC1C=C(C(=C1)C2=NC=C(C=C2)C(F)(F)F)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C20H18F3NO2S/c1-3-13-10-17(14-4-7-16(8-5-14)27(2,25)26)18(11-13)19-9-6-15(12-24-19)20(21,22)23/h4-13H,3H2,1-2H3