N-[4-[1-[bis(fluoranyl)methyl]benzimidazol-2-yl]phenyl]-4-methylsulfanyl-3-nitro-benzamide

Systemtic Name: N-[4-[1-[bis(fluoranyl)methyl]benzimidazol-2-yl]phenyl]-4-methylsulfanyl-3-nitro-benzamide Openeye Name: N-[4-[1-(difluoromethyl)benzimidazol-2-yl]phenyl]-4-methylsulfanyl-3-nitro-benzamide CAS Name: N-[4-[1-(difluoromethyl)-2-benzimidazolyl]phenyl]-4-(methylthio)-3-nitrobenzamide IUPAC Name: N-[4-[1-(difluoromethyl)benzimidazol-2-yl]phenyl]-4-methylsulfanyl-3-nitrobenzamide Traditional Name: N-[4-[1-(difluoromethyl)benzimidazol-2-yl]phenyl]-4-(methylthio)-3-nitro-benzamide Formula: C22H16F2N4O3S MolecularWeight: 454.449246

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4N3C(F)F)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4N3C(F)F)[N+](=O)[O-]

InChI

InChI=1S/C22H16F2N4O3S/c1-32-19-11-8-14(12-18(19)28(30)31)21(29)25-15-9-6-13(7-10-15)20-26-16-4-2-3-5-17(16)27(20)22(23)24/h2-12,22H,1H3,(H,25,29)