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

Systemtic Name: methyl 3-oxidanylidene-2-([1,2,4]triazolo[4,3-a]quinolin-1-ylsulfanyl)butanoate Openeye Name: methyl 3-oxo-2-([1,2,4]triazolo[4,3-a]quinolin-1-ylsulfanyl)butanoate CAS Name: 3-oxo-2-([1,2,4]triazolo[4,3-a]quinolin-1-ylthio)butanoic acid methyl ester IUPAC Name: methyl 3-oxo-2-([1,2,4]triazolo[4,3-a]quinolin-1-ylsulfanyl)butanoate Traditional Name: 3-keto-2-([1,2,4]triazolo[4,3-a]quinolin-1-ylthio)butyric acid methyl ester Formula: C15H13N3O3S MolecularWeight: 315.34702

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=O)OC)SC1=NN=C2N1C3=CC=CC=C3C=C2

Isomeric SMILES

CC(=O)C(C(=O)OC)SC1=NN=C2N1C3=CC=CC=C3C=C2

InChI

InChI=1S/C15H13N3O3S/c1-9(19)13(14(20)21-2)22-15-17-16-12-8-7-10-5-3-4-6-11(10)18(12)15/h3-8,13H,1-2H3