ethyl 4-butylsulfanyl-2-(3-oxidanylidene-4H-quinoxalin-2-yl)butanoate

Systemtic Name: ethyl 4-butylsulfanyl-2-(3-oxidanylidene-4H-quinoxalin-2-yl)butanoate Openeye Name: ethyl 4-butylsulfanyl-2-(3-oxo-4H-quinoxalin-2-yl)butanoate CAS Name: 4-(butylthio)-2-(3-oxo-4H-quinoxalin-2-yl)butanoic acid ethyl ester IUPAC Name: ethyl 4-butylsulfanyl-2-(3-oxo-4H-quinoxalin-2-yl)butanoate Traditional Name: 4-(butylthio)-2-(3-keto-4H-quinoxalin-2-yl)butyric acid ethyl ester Formula: C18H24N2O3S MolecularWeight: 348.45976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCCC(C1=NC2=CC=CC=C2NC1=O)C(=O)OCC

Isomeric SMILES

CCCCSCCC(C1=NC2=CC=CC=C2NC1=O)C(=O)OCC

InChI

InChI=1S/C18H24N2O3S/c1-3-5-11-24-12-10-13(18(22)23-4-2)16-17(21)20-15-9-7-6-8-14(15)19-16/h6-9,13H,3-5,10-12H2,1-2H3,(H,20,21)