N-[4-[2-(1-butyl-5-sulfamoyl-benzimidazol-2-yl)sulfanylethanoyl]phenyl]propanamide

Systemtic Name: N-[4-[2-(1-butyl-5-sulfamoyl-benzimidazol-2-yl)sulfanylethanoyl]phenyl]propanamide Openeye Name: N-[4-[2-(1-butyl-5-sulfamoyl-benzimidazol-2-yl)sulfanylacetyl]phenyl]propanamide CAS Name: N-[4-[2-[(1-butyl-5-sulfamoyl-2-benzimidazolyl)thio]-1-oxoethyl]phenyl]propanamide IUPAC Name: N-[4-[2-(1-butyl-5-sulfamoylbenzimidazol-2-yl)sulfanylacetyl]phenyl]propanamide Traditional Name: N-[4-[2-[(1-butyl-5-sulfamoyl-benzimidazol-2-yl)thio]acetyl]phenyl]propionamide Formula: C22H26N4O4S2 MolecularWeight: 474.59624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)C3=CC=C(C=C3)NC(=O)CC

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)C3=CC=C(C=C3)NC(=O)CC

InChI

InChI=1S/C22H26N4O4S2/c1-3-5-12-26-19-11-10-17(32(23,29)30)13-18(19)25-22(26)31-14-20(27)15-6-8-16(9-7-15)24-21(28)4-2/h6-11,13H,3-5,12,14H2,1-2H3,(H,24,28)(H2,23,29,30)