2-imidazol-1-yl-1-[2-(trifluoromethyl)phenyl]ethanethiol

Systemtic Name: 2-imidazol-1-yl-1-[2-(trifluoromethyl)phenyl]ethanethiol Openeye Name: 2-imidazol-1-yl-1-[2-(trifluoromethyl)phenyl]ethanethiol CAS Name: 2-(1-imidazolyl)-1-[2-(trifluoromethyl)phenyl]ethanethiol IUPAC Name: 2-imidazol-1-yl-1-[2-(trifluoromethyl)phenyl]ethanethiol Traditional Name: 2-imidazol-1-yl-1-[2-(trifluoromethyl)phenyl]ethanethiol Formula: C12H11F3N2S MolecularWeight: 272.28935

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(CN2C=CN=C2)S)C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)C(CN2C=CN=C2)S)C(F)(F)F

InChI

InChI=1S/C12H11F3N2S/c13-12(14,15)10-4-2-1-3-9(10)11(18)7-17-6-5-16-8-17/h1-6,8,11,18H,7H2