N-[(3,4-dimethoxyphenyl)methyl]-2-(1-ethyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-propanamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(1-ethyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-propanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(1-ethyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-propanamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[(1-ethyl-5-sulfamoyl-2-benzimidazolyl)thio]propanamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(1-ethyl-5-sulfamoylbenzimidazol-2-yl)sulfanylpropanamide Traditional Name: 2-[(1-ethyl-5-sulfamoyl-benzimidazol-2-yl)thio]-N-veratryl-propionamide Formula: C21H26N4O5S2 MolecularWeight: 478.58494

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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)NCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SC(C)C(=O)NCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H26N4O5S2/c1-5-25-17-8-7-15(32(22,27)28)11-16(17)24-21(25)31-13(2)20(26)23-12-14-6-9-18(29-3)19(10-14)30-4/h6-11,13H,5,12H2,1-4H3,(H,23,26)(H2,22,27,28)