2-methylsulfanyl-4-(trifluoromethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile

Systemtic Name: 2-methylsulfanyl-4-(trifluoromethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile Openeye Name: 2-methylsulfanyl-4-(trifluoromethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile CAS Name: 2-(methylthio)-4-(trifluoromethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile IUPAC Name: 2-methylsulfanyl-4-(trifluoromethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile Traditional Name: 2-(methylthio)-4-(trifluoromethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile Formula: C13H13F3N2S MolecularWeight: 286.31593

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(CCCCC2)C(=C1C#N)C(F)(F)F

Isomeric SMILES

CSC1=NC2=C(CCCCC2)C(=C1C#N)C(F)(F)F

InChI

InChI=1S/C13H13F3N2S/c1-19-12-9(7-17)11(13(14,15)16)8-5-3-2-4-6-10(8)18-12/h2-6H2,1H3