1H-benzimidazol-2-ylsulfanyl 3-oxidanylidenebutanoate

Systemtic Name: 1H-benzimidazol-2-ylsulfanyl 3-oxidanylidenebutanoate Openeye Name: 1H-benzimidazol-2-ylsulfanyl 3-oxobutanoate CAS Name: 3-oxobutanoic acid (1H-benzimidazol-2-ylthio) ester IUPAC Name: 1H-benzimidazol-2-ylsulfanyl 3-oxobutanoate Traditional Name: 3-ketobutyric acid (1H-benzimidazol-2-ylthio) ester Formula: C11H10N2O3S MolecularWeight: 250.2737

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)OSC1=NC2=CC=CC=C2N1

Isomeric SMILES

CC(=O)CC(=O)OSC1=NC2=CC=CC=C2N1

InChI

InChI=1S/C11H10N2O3S/c1-7(14)6-10(15)16-17-11-12-8-4-2-3-5-9(8)13-11/h2-5H,6H2,1H3,(H,12,13)