N-[2-(cyclohexen-1-yl)ethylcarbamoyl]-2-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethylcarbamoyl]-2-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-[2-(cyclohexen-1-yl)ethylcarbamoyl]-2-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-[[2-(1-cyclohexenyl)ethylamino]-oxomethyl]-2-[(1-propyl-5-sulfamoyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-[2-(cyclohexen-1-yl)ethylcarbamoyl]-2-(1-propyl-5-sulfamoylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-[2-(cyclohexen-1-yl)ethylcarbamoyl]-2-[(1-propyl-5-sulfamoyl-benzimidazol-2-yl)thio]acetamide Formula: C21H29N5O4S2 MolecularWeight: 479.61606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)NC(=O)NCCC3=CCCCC3

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)NC(=O)NCCC3=CCCCC3

InChI

InChI=1S/C21H29N5O4S2/c1-2-12-26-18-9-8-16(32(22,29)30)13-17(18)24-21(26)31-14-19(27)25-20(28)23-11-10-15-6-4-3-5-7-15/h6,8-9,13H,2-5,7,10-12,14H2,1H3,(H2,22,29,30)(H2,23,25,27,28)