ethyl 3-oxidanylidene-4-([1,2,4]triazolo[4,3-a]quinolin-1-ylsulfanyl)butanoate

Systemtic Name: ethyl 3-oxidanylidene-4-([1,2,4]triazolo[4,3-a]quinolin-1-ylsulfanyl)butanoate Openeye Name: ethyl 3-oxo-4-([1,2,4]triazolo[4,3-a]quinolin-1-ylsulfanyl)butanoate CAS Name: 3-oxo-4-([1,2,4]triazolo[4,3-a]quinolin-1-ylthio)butanoic acid ethyl ester IUPAC Name: ethyl 3-oxo-4-([1,2,4]triazolo[4,3-a]quinolin-1-ylsulfanyl)butanoate Traditional Name: 3-keto-4-([1,2,4]triazolo[4,3-a]quinolin-1-ylthio)butyric acid ethyl ester Formula: C16H15N3O3S MolecularWeight: 329.3736

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)CSC1=NN=C2N1C3=CC=CC=C3C=C2

Isomeric SMILES

CCOC(=O)CC(=O)CSC1=NN=C2N1C3=CC=CC=C3C=C2

InChI

InChI=1S/C16H15N3O3S/c1-2-22-15(21)9-12(20)10-23-16-18-17-14-8-7-11-5-3-4-6-13(11)19(14)16/h3-8H,2,9-10H2,1H3