methyl (2S)-4-methylsulfanyl-2-[(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)carbonylamino]butanoate

Systemtic Name: methyl (2S)-4-methylsulfanyl-2-[(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)carbonylamino]butanoate Openeye Name: methyl (2S)-4-methylsulfanyl-2-[(3-oxo-2,4-dihydroquinoxaline-1-carbonyl)amino]butanoate CAS Name: (2S)-4-(methylthio)-2-[[oxo-(3-oxo-2,4-dihydroquinoxalin-1-yl)methyl]amino]butanoic acid methyl ester IUPAC Name: methyl (2S)-4-methylsulfanyl-2-[(3-oxo-2,4-dihydroquinoxaline-1-carbonyl)amino]butanoate Traditional Name: (2S)-2-[(3-keto-2,4-dihydroquinoxaline-1-carbonyl)amino]-4-(methylthio)butyric acid methyl ester Formula: C15H19N3O4S MolecularWeight: 337.39406

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)N1CC(=O)NC2=CC=CC=C21

Isomeric SMILES

COC(=O)[C@H](CCSC)NC(=O)N1CC(=O)NC2=CC=CC=C21

InChI

InChI=1S/C15H19N3O4S/c1-22-14(20)11(7-8-23-2)17-15(21)18-9-13(19)16-10-5-3-4-6-12(10)18/h3-6,11H,7-9H2,1-2H3,(H,16,19)(H,17,21)/t11-/m0/s1