2-[5-chloranyl-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-N-(4-fluoranyl-3-nitro-phenyl)ethanamide

Systemtic Name: 2-[5-chloranyl-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-N-(4-fluoranyl-3-nitro-phenyl)ethanamide Openeye Name: 2-[5-chloro-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-N-(4-fluoro-3-nitro-phenyl)acetamide CAS Name: 2-[[5-chloro-1-(2-methoxyethyl)-2-benzimidazolyl]thio]-N-(4-fluoro-3-nitrophenyl)acetamide IUPAC Name: 2-[5-chloro-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-N-(4-fluoro-3-nitrophenyl)acetamide Traditional Name: 2-[[5-chloro-1-(2-methoxyethyl)benzimidazol-2-yl]thio]-N-(4-fluoro-3-nitro-phenyl)acetamide Formula: C18H16ClFN4O4S MolecularWeight: 438.860443

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

COCCN1C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C18H16ClFN4O4S/c1-28-7-6-23-15-5-2-11(19)8-14(15)22-18(23)29-10-17(25)21-12-3-4-13(20)16(9-12)24(26)27/h2-5,8-9H,6-7,10H2,1H3,(H,21,25)