ethyl 5-(1H-benzimidazol-2-ylsulfanylmethyl)-2-oxidanylidene-1,3-dihydroimidazole-4-carboxylate

Systemtic Name: ethyl 5-(1H-benzimidazol-2-ylsulfanylmethyl)-2-oxidanylidene-1,3-dihydroimidazole-4-carboxylate Openeye Name: ethyl 5-(1H-benzimidazol-2-ylsulfanylmethyl)-2-oxo-1,3-dihydroimidazole-4-carboxylate CAS Name: 5-[(1H-benzimidazol-2-ylthio)methyl]-2-oxo-1,3-dihydroimidazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(1H-benzimidazol-2-ylsulfanylmethyl)-2-oxo-1,3-dihydroimidazole-4-carboxylate Traditional Name: 5-[(1H-benzimidazol-2-ylthio)methyl]-2-keto-4-imidazoline-4-carboxylic acid ethyl ester Formula: C14H14N4O3S MolecularWeight: 318.35096

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)N1)CSC2=NC3=CC=CC=C3N2

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N1)CSC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C14H14N4O3S/c1-2-21-12(19)11-10(15-13(20)18-11)7-22-14-16-8-5-3-4-6-9(8)17-14/h3-6H,2,7H2,1H3,(H,16,17)(H2,15,18,20)