3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]-N-(4-fluoranyl-3-nitro-phenyl)propanamide

Systemtic Name: 3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]-N-(4-fluoranyl-3-nitro-phenyl)propanamide Openeye Name: 3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]-N-(4-fluoro-3-nitro-phenyl)propanamide CAS Name: 3-[5-(dimethylsulfamoyl)-1-ethyl-2-benzimidazolyl]-N-(4-fluoro-3-nitrophenyl)propanamide IUPAC Name: 3-[5-(dimethylsulfamoyl)-1-ethylbenzimidazol-2-yl]-N-(4-fluoro-3-nitrophenyl)propanamide Traditional Name: 3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]-N-(4-fluoro-3-nitro-phenyl)propionamide Formula: C20H22FN5O5S MolecularWeight: 463.482583

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CCC(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CCC(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C20H22FN5O5S/c1-4-25-17-8-6-14(32(30,31)24(2)3)12-16(17)23-19(25)9-10-20(27)22-13-5-7-15(21)18(11-13)26(28)29/h5-8,11-12H,4,9-10H2,1-3H3,(H,22,27)