2-[1-(4-fluorophenyl)-5-nitro-benzimidazol-2-yl]sulfanyl-N-prop-2-enyl-ethanamide

Systemtic Name: 2-[1-(4-fluorophenyl)-5-nitro-benzimidazol-2-yl]sulfanyl-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[1-(4-fluorophenyl)-5-nitro-benzimidazol-2-yl]sulfanyl-acetamide CAS Name: 2-[[1-(4-fluorophenyl)-5-nitro-2-benzimidazolyl]thio]-N-prop-2-enylacetamide IUPAC Name: 2-[1-(4-fluorophenyl)-5-nitrobenzimidazol-2-yl]sulfanyl-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[[1-(4-fluorophenyl)-5-nitro-benzimidazol-2-yl]thio]acetamide Formula: C18H15FN4O3S MolecularWeight: 386.400103

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)CSC1=NC2=C(N1C3=CC=C(C=C3)F)C=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

C=CCNC(=O)CSC1=NC2=C(N1C3=CC=C(C=C3)F)C=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H15FN4O3S/c1-2-9-20-17(24)11-27-18-21-15-10-14(23(25)26)7-8-16(15)22(18)13-5-3-12(19)4-6-13/h2-8,10H,1,9,11H2,(H,20,24)