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

Systemtic Name: ethyl 5-(1,3-benzothiazol-2-ylsulfanylmethyl)-2-oxidanylidene-1,3-dihydroimidazole-4-carboxylate Openeye Name: ethyl 5-(1,3-benzothiazol-2-ylsulfanylmethyl)-2-oxo-1,3-dihydroimidazole-4-carboxylate CAS Name: 5-[(1,3-benzothiazol-2-ylthio)methyl]-2-oxo-1,3-dihydroimidazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(1,3-benzothiazol-2-ylsulfanylmethyl)-2-oxo-1,3-dihydroimidazole-4-carboxylate Traditional Name: 5-[(1,3-benzothiazol-2-ylthio)methyl]-2-keto-4-imidazoline-4-carboxylic acid ethyl ester Formula: C14H13N3O3S2 MolecularWeight: 335.40132

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)N1)CSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N1)CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C14H13N3O3S2/c1-2-20-12(18)11-9(15-13(19)17-11)7-21-14-16-8-5-3-4-6-10(8)22-14/h3-6H,2,7H2,1H3,(H2,15,17,19)