2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[(6-nitro-1H-benzimidazol-2-yl)thio]-N-[3-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[(6-nitro-1H-benzimidazol-2-yl)thio]-N-[3-(trifluoromethyl)phenyl]acetamide Formula: C16H11F3N4O3S MolecularWeight: 396.34375

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CSC2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CSC2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C16H11F3N4O3S/c17-16(18,19)9-2-1-3-10(6-9)20-14(24)8-27-15-21-12-5-4-11(23(25)26)7-13(12)22-15/h1-7H,8H2,(H,20,24)(H,21,22)