zinc (2S)-4-ethylsulfanyl-2-[(1-oxidanyl-2H-pyridin-6-yl)amino]butanoate

Systemtic Name: zinc (2S)-4-ethylsulfanyl-2-[(1-oxidanyl-2H-pyridin-6-yl)amino]butanoate Openeye Name: zinc (2S)-4-ethylsulfanyl-2-[(1-hydroxy-2H-pyridin-6-yl)amino]butanoate CAS Name: zinc (2S)-4-(ethylthio)-2-[(1-hydroxy-2H-pyridin-6-yl)amino]butanoate IUPAC Name: zinc (2S)-4-ethylsulfanyl-2-[(1-hydroxy-2H-pyridin-6-yl)amino]butanoate Traditional Name: zinc (2S)-4-(ethylthio)-2-[(1-hydroxy-2H-pyridin-6-yl)amino]butyrate Formula: C22H34N4O6S2Zn MolecularWeight: 580.06756

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Descriptors Computed from Structure

Canonical SMILES:

CCSCCC(C(=O)[O-])NC1=CC=CCN1O.CCSCCC(C(=O)[O-])NC1=CC=CCN1O.[Zn+2]

Isomeric SMILES

CCSCC[C@@H](C(=O)[O-])NC1=CC=CCN1O.CCSCC[C@@H](C(=O)[O-])NC1=CC=CCN1O.[Zn+2]

InChI

InChI=1S/2C11H18N2O3S.Zn/c2*1-2-17-8-6-9(11(14)15)12-10-5-3-4-7-13(10)16;/h2*3-5,9,12,16H,2,6-8H2,1H3,(H,14,15);/q;;+2/p-2/t2*9-;/m00./s1