3-[2-[2-[2,5-bis(fluoranyl)phenyl]-2-oxidanylidene-ethyl]sulfanylbenzimidazol-1-yl]propanenitrile

Systemtic Name: 3-[2-[2-[2,5-bis(fluoranyl)phenyl]-2-oxidanylidene-ethyl]sulfanylbenzimidazol-1-yl]propanenitrile Openeye Name: 3-[2-[2-(2,5-difluorophenyl)-2-oxo-ethyl]sulfanylbenzimidazol-1-yl]propanenitrile CAS Name: 3-[2-[[2-(2,5-difluorophenyl)-2-oxoethyl]thio]-1-benzimidazolyl]propanenitrile IUPAC Name: 3-[2-[2-(2,5-difluorophenyl)-2-oxoethyl]sulfanylbenzimidazol-1-yl]propanenitrile Traditional Name: 3-[2-[[2-(2,5-difluorophenyl)-2-keto-ethyl]thio]benzimidazol-1-yl]propionitrile Formula: C18H13F2N3OS MolecularWeight: 357.377126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2CCC#N)SCC(=O)C3=C(C=CC(=C3)F)F

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2CCC#N)SCC(=O)C3=C(C=CC(=C3)F)F

InChI

InChI=1S/C18H13F2N3OS/c19-12-6-7-14(20)13(10-12)17(24)11-25-18-22-15-4-1-2-5-16(15)23(18)9-3-8-21/h1-2,4-7,10H,3,9,11H2