ethyl 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-3-oxidanylidene-butanoate

Systemtic Name: ethyl 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-3-oxidanylidene-butanoate Openeye Name: ethyl 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-3-oxo-butanoate CAS Name: 2-(4,5-dihydro-1H-imidazol-2-ylthio)-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-3-oxobutanoate Traditional Name: 2-(2-imidazolin-2-ylthio)-3-keto-butyric acid ethyl ester Formula: C9H14N2O3S MolecularWeight: 230.28406

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)C)SC1=NCCN1

Isomeric SMILES

CCOC(=O)C(C(=O)C)SC1=NCCN1

InChI

InChI=1S/C9H14N2O3S/c1-3-14-8(13)7(6(2)12)15-9-10-4-5-11-9/h7H,3-5H2,1-2H3,(H,10,11)