[2-(ethylcarbamoylamino)-2-oxidanylidene-ethyl] 4-(1H-benzimidazol-2-ylsulfanyl)butanoate

Systemtic Name: [2-(ethylcarbamoylamino)-2-oxidanylidene-ethyl] 4-(1H-benzimidazol-2-ylsulfanyl)butanoate Openeye Name: [2-(ethylcarbamoylamino)-2-oxo-ethyl] 4-(1H-benzimidazol-2-ylsulfanyl)butanoate CAS Name: 4-(1H-benzimidazol-2-ylthio)butanoic acid [2-(ethylcarbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(ethylcarbamoylamino)-2-oxoethyl] 4-(1H-benzimidazol-2-ylsulfanyl)butanoate Traditional Name: 4-(1H-benzimidazol-2-ylthio)butyric acid [2-(ethylcarbamoylamino)-2-keto-ethyl] ester Formula: C16H20N4O4S MolecularWeight: 364.4194

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)COC(=O)CCCSC1=NC2=CC=CC=C2N1

Isomeric SMILES

CCNC(=O)NC(=O)COC(=O)CCCSC1=NC2=CC=CC=C2N1

InChI

InChI=1S/C16H20N4O4S/c1-2-17-15(23)20-13(21)10-24-14(22)8-5-9-25-16-18-11-6-3-4-7-12(11)19-16/h3-4,6-7H,2,5,8-10H2,1H3,(H,18,19)(H2,17,20,21,23)