N-[2-(4-methoxyphenyl)ethyl]-2-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-(4-methoxyphenyl)ethyl]-2-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-[2-(4-methoxyphenyl)ethyl]-2-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-[2-(4-methoxyphenyl)ethyl]-2-[(1-propyl-5-sulfamoyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-[2-(4-methoxyphenyl)ethyl]-2-(1-propyl-5-sulfamoylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-[2-(4-methoxyphenyl)ethyl]-2-[(1-propyl-5-sulfamoyl-benzimidazol-2-yl)thio]acetamide Formula: C21H26N4O4S2 MolecularWeight: 462.58554

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)NCCC3=CC=C(C=C3)OC

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)NCCC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H26N4O4S2/c1-3-12-25-19-9-8-17(31(22,27)28)13-18(19)24-21(25)30-14-20(26)23-11-10-15-4-6-16(29-2)7-5-15/h4-9,13H,3,10-12,14H2,1-2H3,(H,23,26)(H2,22,27,28)