methyl 5-cyano-1-[[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]methyl]-6-oxidanylidene-pyridine-3-carboxylate

Systemtic Name: methyl 5-cyano-1-[[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]methyl]-6-oxidanylidene-pyridine-3-carboxylate Openeye Name: methyl 5-cyano-1-[[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]methyl]-6-oxo-pyridine-3-carboxylate CAS Name: 5-cyano-1-[[5-(dimethylsulfamoyl)-1-ethyl-2-benzimidazolyl]methyl]-6-oxo-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-cyano-1-[[5-(dimethylsulfamoyl)-1-ethylbenzimidazol-2-yl]methyl]-6-oxopyridine-3-carboxylate Traditional Name: 5-cyano-1-[[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]methyl]-6-keto-nicotinic acid methyl ester Formula: C20H21N5O5S MolecularWeight: 443.47624

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CN3C=C(C=C(C3=O)C#N)C(=O)OC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CN3C=C(C=C(C3=O)C#N)C(=O)OC

InChI

InChI=1S/C20H21N5O5S/c1-5-25-17-7-6-15(31(28,29)23(2)3)9-16(17)22-18(25)12-24-11-14(20(27)30-4)8-13(10-21)19(24)26/h6-9,11H,5,12H2,1-4H3