[2-(ethoxycarbonylamino)-2-oxidanylidene-ethyl] 2-(1H-benzimidazol-2-ylsulfanylmethyl)benzoate

Systemtic Name: [2-(ethoxycarbonylamino)-2-oxidanylidene-ethyl] 2-(1H-benzimidazol-2-ylsulfanylmethyl)benzoate Openeye Name: [2-(ethoxycarbonylamino)-2-oxo-ethyl] 2-(1H-benzimidazol-2-ylsulfanylmethyl)benzoate CAS Name: 2-[(1H-benzimidazol-2-ylthio)methyl]benzoic acid [2-(ethoxycarbonylamino)-2-oxoethyl] ester IUPAC Name: [2-(ethoxycarbonylamino)-2-oxoethyl] 2-(1H-benzimidazol-2-ylsulfanylmethyl)benzoate Traditional Name: 2-[(1H-benzimidazol-2-ylthio)methyl]benzoic acid [2-(carbethoxyamino)-2-keto-ethyl] ester Formula: C20H19N3O5S MolecularWeight: 413.44696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=O)COC(=O)C1=CC=CC=C1CSC2=NC3=CC=CC=C3N2

Isomeric SMILES

CCOC(=O)NC(=O)COC(=O)C1=CC=CC=C1CSC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C20H19N3O5S/c1-2-27-20(26)23-17(24)11-28-18(25)14-8-4-3-7-13(14)12-29-19-21-15-9-5-6-10-16(15)22-19/h3-10H,2,11-12H2,1H3,(H,21,22)(H,23,24,26)