4-[2-(4-methylsulfanylphenyl)-5-(trifluoromethyl)-1H-pyrazol-3-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[2-(4-methylsulfanylphenyl)-5-(trifluoromethyl)-1H-pyrazol-3-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[2-(4-methylsulfanylphenyl)-5-(trifluoromethyl)-1H-pyrazol-3-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[2-[4-(methylthio)phenyl]-5-(trifluoromethyl)-1H-pyrazol-3-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[2-(4-methylsulfanylphenyl)-5-(trifluoromethyl)-1H-pyrazol-3-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[2-[4-(methylthio)phenyl]-5-(trifluoromethyl)-3-pyrazolin-3-ylidene]cyclohexa-2,5-dien-1-one Formula: C17H13F3N2OS MolecularWeight: 350.35813

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)N2C(=C3C=CC(=O)C=C3)C=C(N2)C(F)(F)F

Isomeric SMILES

CSC1=CC=C(C=C1)N2C(=C3C=CC(=O)C=C3)C=C(N2)C(F)(F)F

InChI

InChI=1S/C17H13F3N2OS/c1-24-14-8-4-12(5-9-14)22-15(10-16(21-22)17(18,19)20)11-2-6-13(23)7-3-11/h2-10,21H,1H3