3-chloranyl-5-[3-ethyl-2-(hydroxymethyl)-5-(trifluoromethyl)imidazol-4-yl]sulfanyl-benzenecarbonitrile

Systemtic Name: 3-chloranyl-5-[3-ethyl-2-(hydroxymethyl)-5-(trifluoromethyl)imidazol-4-yl]sulfanyl-benzenecarbonitrile Openeye Name: 3-chloro-5-[3-ethyl-2-(hydroxymethyl)-5-(trifluoromethyl)imidazol-4-yl]sulfanyl-benzonitrile CAS Name: 3-chloro-5-[[3-ethyl-2-(hydroxymethyl)-5-(trifluoromethyl)-4-imidazolyl]thio]benzonitrile IUPAC Name: 3-chloro-5-[3-ethyl-2-(hydroxymethyl)-5-(trifluoromethyl)imidazol-4-yl]sulfanylbenzonitrile Traditional Name: 3-chloro-5-[[3-ethyl-2-methylol-5-(trifluoromethyl)imidazol-4-yl]thio]benzonitrile Formula: C14H11ClF3N3OS MolecularWeight: 361.76985

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC(=C1SC2=CC(=CC(=C2)C#N)Cl)C(F)(F)F)CO

Isomeric SMILES

CCN1C(=NC(=C1SC2=CC(=CC(=C2)C#N)Cl)C(F)(F)F)CO

InChI

InChI=1S/C14H11ClF3N3OS/c1-2-21-11(7-22)20-12(14(16,17)18)13(21)23-10-4-8(6-19)3-9(15)5-10/h3-5,22H,2,7H2,1H3