ethyl 3-(1H-benzimidazol-2-ylsulfanyl)-2-(1H-benzimidazol-2-ylsulfanylmethyl)-4-oxidanyl-5-oxidanylidene-furan-2-carboxylate

Systemtic Name: ethyl 3-(1H-benzimidazol-2-ylsulfanyl)-2-(1H-benzimidazol-2-ylsulfanylmethyl)-4-oxidanyl-5-oxidanylidene-furan-2-carboxylate Openeye Name: ethyl 3-(1H-benzimidazol-2-ylsulfanyl)-2-(1H-benzimidazol-2-ylsulfanylmethyl)-4-hydroxy-5-oxo-furan-2-carboxylate CAS Name: 3-(1H-benzimidazol-2-ylthio)-2-[(1H-benzimidazol-2-ylthio)methyl]-4-hydroxy-5-oxo-2-furancarboxylic acid ethyl ester IUPAC Name: ethyl 3-(1H-benzimidazol-2-ylsulfanyl)-2-(1H-benzimidazol-2-ylsulfanylmethyl)-4-hydroxy-5-oxofuran-2-carboxylate Traditional Name: 3-(1H-benzimidazol-2-ylthio)-2-[(1H-benzimidazol-2-ylthio)methyl]-4-hydroxy-5-keto-furan-2-carboxylic acid ethyl ester Formula: C22H18N4O5S2 MolecularWeight: 482.53212

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(=C(C(=O)O1)O)SC2=NC3=CC=CC=C3N2)CSC4=NC5=CC=CC=C5N4

Isomeric SMILES

CCOC(=O)C1(C(=C(C(=O)O1)O)SC2=NC3=CC=CC=C3N2)CSC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C22H18N4O5S2/c1-2-30-19(29)22(11-32-20-23-12-7-3-4-8-13(12)24-20)17(16(27)18(28)31-22)33-21-25-14-9-5-6-10-15(14)26-21/h3-10,27H,2,11H2,1H3,(H,23,24)(H,25,26)