4-cyano-1-(trifluoromethyl)-5,6,7,8-tetrahydroisoquinoline-3-thiolate

Systemtic Name: 4-cyano-1-(trifluoromethyl)-5,6,7,8-tetrahydroisoquinoline-3-thiolate Openeye Name: 4-cyano-1-(trifluoromethyl)-5,6,7,8-tetrahydroisoquinoline-3-thiolate CAS Name: 4-cyano-1-(trifluoromethyl)-5,6,7,8-tetrahydroisoquinoline-3-thiolate IUPAC Name: 4-cyano-1-(trifluoromethyl)-5,6,7,8-tetrahydroisoquinoline-3-thiolate Traditional Name: 4-cyano-1-(trifluoromethyl)-5,6,7,8-tetrahydroisoquinoline-3-thiolate Formula: C11H8F3N2S- MolecularWeight: 257.25483

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(N=C(C(=C2C1)C#N)[S-])C(F)(F)F

Isomeric SMILES

C1CCC2=C(N=C(C(=C2C1)C#N)[S-])C(F)(F)F

InChI

InChI=1S/C11H9F3N2S/c12-11(13,14)9-7-4-2-1-3-6(7)8(5-15)10(17)16-9/h1-4H2,(H,16,17)/p-1