2-(1-ethyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-N-(4-fluoranyl-3-nitro-phenyl)propanamide

Systemtic Name: 2-(1-ethyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-N-(4-fluoranyl-3-nitro-phenyl)propanamide Openeye Name: 2-(1-ethyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-N-(4-fluoro-3-nitro-phenyl)propanamide CAS Name: 2-[(1-ethyl-5-sulfamoyl-2-benzimidazolyl)thio]-N-(4-fluoro-3-nitrophenyl)propanamide IUPAC Name: 2-(1-ethyl-5-sulfamoylbenzimidazol-2-yl)sulfanyl-N-(4-fluoro-3-nitrophenyl)propanamide Traditional Name: 2-[(1-ethyl-5-sulfamoyl-benzimidazol-2-yl)thio]-N-(4-fluoro-3-nitro-phenyl)propionamide Formula: C18H18FN5O5S2 MolecularWeight: 467.494423

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SC(C)C(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SC(C)C(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C18H18FN5O5S2/c1-3-23-15-7-5-12(31(20,28)29)9-14(15)22-18(23)30-10(2)17(25)21-11-4-6-13(19)16(8-11)24(26)27/h4-10H,3H2,1-2H3,(H,21,25)(H2,20,28,29)