ethyl 1-ethyl-2-[2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl]sulfanyl-benzimidazole-5-carboxylate

Systemtic Name: ethyl 1-ethyl-2-[2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl]sulfanyl-benzimidazole-5-carboxylate Openeye Name: ethyl 2-[2-(allylcarbamoylamino)-2-oxo-ethyl]sulfanyl-1-ethyl-benzimidazole-5-carboxylate CAS Name: 1-ethyl-2-[[2-oxo-2-[[oxo-(prop-2-enylamino)methyl]amino]ethyl]thio]-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-2-[2-oxo-2-(prop-2-enylcarbamoylamino)ethyl]sulfanylbenzimidazole-5-carboxylate Traditional Name: 2-[[2-(allylcarbamoylamino)-2-keto-ethyl]thio]-1-ethyl-benzimidazole-5-carboxylic acid ethyl ester Formula: C18H22N4O4S MolecularWeight: 390.45668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SCC(=O)NC(=O)NCC=C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SCC(=O)NC(=O)NCC=C

InChI

InChI=1S/C18H22N4O4S/c1-4-9-19-17(25)21-15(23)11-27-18-20-13-10-12(16(24)26-6-3)7-8-14(13)22(18)5-2/h4,7-8,10H,1,5-6,9,11H2,2-3H3,(H2,19,21,23,25)