methyl 2-[5-(diethylsulfamoyl)-1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanylethanoate

Systemtic Name: methyl 2-[5-(diethylsulfamoyl)-1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanylethanoate Openeye Name: methyl 2-[5-(diethylsulfamoyl)-1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanylacetate CAS Name: 2-[[5-(diethylsulfamoyl)-1-(4-methoxyphenyl)-2-benzimidazolyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[5-(diethylsulfamoyl)-1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanylacetate Traditional Name: 2-[[5-(diethylsulfamoyl)-1-(4-methoxyphenyl)benzimidazol-2-yl]thio]acetic acid methyl ester Formula: C21H25N3O5S2 MolecularWeight: 463.5703

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC(=O)OC)C3=CC=C(C=C3)OC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC(=O)OC)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H25N3O5S2/c1-5-23(6-2)31(26,27)17-11-12-19-18(13-17)22-21(30-14-20(25)29-4)24(19)15-7-9-16(28-3)10-8-15/h7-13H,5-6,14H2,1-4H3