[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]methyl 2-quinoxalin-2-ylsulfanylethanoate

Systemtic Name: [5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]methyl 2-quinoxalin-2-ylsulfanylethanoate Openeye Name: [5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]methyl 2-quinoxalin-2-ylsulfanylacetate CAS Name: 2-(2-quinoxalinylthio)acetic acid [5-(dimethylsulfamoyl)-1-ethyl-2-benzimidazolyl]methyl ester IUPAC Name: [5-(dimethylsulfamoyl)-1-ethylbenzimidazol-2-yl]methyl 2-quinoxalin-2-ylsulfanylacetate Traditional Name: 2-(quinoxalin-2-ylthio)acetic acid [5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]methyl ester Formula: C22H23N5O4S2 MolecularWeight: 485.57912

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1COC(=O)CSC3=NC4=CC=CC=C4N=C3

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1COC(=O)CSC3=NC4=CC=CC=C4N=C3

InChI

InChI=1S/C22H23N5O4S2/c1-4-27-19-10-9-15(33(29,30)26(2)3)11-18(19)24-20(27)13-31-22(28)14-32-21-12-23-16-7-5-6-8-17(16)25-21/h5-12H,4,13-14H2,1-3H3