2-[1-[bis(fluoranyl)methyl]benzimidazol-2-yl]sulfanyl-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[1-[bis(fluoranyl)methyl]benzimidazol-2-yl]sulfanyl-5-nitro-benzenecarbonitrile Openeye Name: 2-[1-(difluoromethyl)benzimidazol-2-yl]sulfanyl-5-nitro-benzonitrile CAS Name: 2-[[1-(difluoromethyl)-2-benzimidazolyl]thio]-5-nitrobenzonitrile IUPAC Name: 2-[1-(difluoromethyl)benzimidazol-2-yl]sulfanyl-5-nitrobenzonitrile Traditional Name: 2-[[1-(difluoromethyl)benzimidazol-2-yl]thio]-5-nitro-benzonitrile Formula: C15H8F2N4O2S MolecularWeight: 346.311426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2C(F)F)SC3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2C(F)F)SC3=C(C=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C15H8F2N4O2S/c16-14(17)20-12-4-2-1-3-11(12)19-15(20)24-13-6-5-10(21(22)23)7-9(13)8-18/h1-7,14H