2-(1,3-dimethylbenzimidazol-2-ylidene)-4-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]sulfanyl]-3-oxidanylidene-butanenitrile

Systemtic Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-4-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]sulfanyl]-3-oxidanylidene-butanenitrile Openeye Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-4-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]sulfanyl]-3-oxo-butanenitrile CAS Name: 2-(1,3-dimethyl-2-benzimidazolylidene)-4-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]thio]-3-oxobutanenitrile IUPAC Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-4-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]sulfanyl]-3-oxobutanenitrile Traditional Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-4-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]thio]-3-keto-butyronitrile Formula: C22H18FN5OS MolecularWeight: 419.474623

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=C(C#N)C(=O)CSC3=NC=C(N3)C4=CC=C(C=C4)F)C

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=C(C#N)C(=O)CSC3=NC=C(N3)C4=CC=C(C=C4)F)C

InChI

InChI=1S/C22H18FN5OS/c1-27-18-5-3-4-6-19(18)28(2)21(27)16(11-24)20(29)13-30-22-25-12-17(26-22)14-7-9-15(23)10-8-14/h3-10,12H,13H2,1-2H3,(H,25,26)