ethyl 3-(1H-benzimidazol-2-ylsulfanyl)-4,5-bis(oxidanylidene)oxolane-2-carboxylate

Systemtic Name: ethyl 3-(1H-benzimidazol-2-ylsulfanyl)-4,5-bis(oxidanylidene)oxolane-2-carboxylate Openeye Name: ethyl 3-(1H-benzimidazol-2-ylsulfanyl)-4,5-dioxo-tetrahydrofuran-2-carboxylate CAS Name: 3-(1H-benzimidazol-2-ylthio)-4,5-dioxo-2-oxolanecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(1H-benzimidazol-2-ylsulfanyl)-4,5-dioxooxolane-2-carboxylate Traditional Name: 3-(1H-benzimidazol-2-ylthio)-4,5-diketo-tetrahydrofuran-2-carboxylic acid ethyl ester Formula: C14H12N2O5S MolecularWeight: 320.32048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C(=O)C(=O)O1)SC2=NC3=CC=CC=C3N2

Isomeric SMILES

CCOC(=O)C1C(C(=O)C(=O)O1)SC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C14H12N2O5S/c1-2-20-13(19)10-11(9(17)12(18)21-10)22-14-15-7-5-3-4-6-8(7)16-14/h3-6,10-11H,2H2,1H3,(H,15,16)