(2S)-4-methylsulfanyl-2-[(5-nitropyridin-2-yl)amino]butanoate

Systemtic Name: (2S)-4-methylsulfanyl-2-[(5-nitropyridin-2-yl)amino]butanoate Openeye Name: (2S)-4-methylsulfanyl-2-[(5-nitro-2-pyridyl)amino]butanoate CAS Name: (2S)-4-(methylthio)-2-[(5-nitro-2-pyridinyl)amino]butanoate IUPAC Name: (2S)-4-methylsulfanyl-2-[(5-nitropyridin-2-yl)amino]butanoate Traditional Name: (2S)-4-(methylthio)-2-[(5-nitro-2-pyridyl)amino]butyrate Formula: C10H12N3O4S- MolecularWeight: 270.28498

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)[O-])NC1=NC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CSCC[C@@H](C(=O)[O-])NC1=NC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C10H13N3O4S/c1-18-5-4-8(10(14)15)12-9-3-2-7(6-11-9)13(16)17/h2-3,6,8H,4-5H2,1H3,(H,11,12)(H,14,15)/p-1/t8-/m0/s1