(2S)-4-methylsulfanyl-2-[(2-oxidanylidenechromen-6-yl)carbamoylamino]butanoate

Systemtic Name: (2S)-4-methylsulfanyl-2-[(2-oxidanylidenechromen-6-yl)carbamoylamino]butanoate Openeye Name: (2S)-4-methylsulfanyl-2-[(2-oxochromen-6-yl)carbamoylamino]butanoate CAS Name: (2S)-4-(methylthio)-2-[[oxo-[(2-oxo-1-benzopyran-6-yl)amino]methyl]amino]butanoate IUPAC Name: (2S)-4-methylsulfanyl-2-[(2-oxochromen-6-yl)carbamoylamino]butanoate Traditional Name: (2S)-2-[(2-ketochromen-6-yl)carbamoylamino]-4-(methylthio)butyrate Formula: C15H15N2O5S- MolecularWeight: 335.355

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)[O-])NC(=O)NC1=CC2=C(C=C1)OC(=O)C=C2

Isomeric SMILES

CSCC[C@@H](C(=O)[O-])NC(=O)NC1=CC2=C(C=C1)OC(=O)C=C2

InChI

InChI=1S/C15H16N2O5S/c1-23-7-6-11(14(19)20)17-15(21)16-10-3-4-12-9(8-10)2-5-13(18)22-12/h2-5,8,11H,6-7H2,1H3,(H,19,20)(H2,16,17,21)/p-1/t11-/m0/s1