2-[(5-methyl-4-oxidanylidene-3,1-benzoxazin-2-yl)amino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[(5-methyl-4-oxidanylidene-3,1-benzoxazin-2-yl)amino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[(5-methyl-4-oxo-3,1-benzoxazin-2-yl)amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[(5-methyl-4-oxo-3,1-benzoxazin-2-yl)amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[(5-methyl-4-oxo-3,1-benzoxazin-2-yl)amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[(4-keto-5-methyl-3,1-benzoxazin-2-yl)amino]-4-(methylthio)butyric acid Formula: C14H16N2O4S MolecularWeight: 308.35284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N=C(OC2=O)NC(CCSC)C(=O)O

Isomeric SMILES

CC1=C2C(=CC=C1)N=C(OC2=O)NC(CCSC)C(=O)O

InChI

InChI=1S/C14H16N2O4S/c1-8-4-3-5-9-11(8)13(19)20-14(15-9)16-10(12(17)18)6-7-21-2/h3-5,10H,6-7H2,1-2H3,(H,15,16)(H,17,18)