(2S)-2-(1H-indazol-3-ylcarbonylamino)-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-(1H-indazol-3-ylcarbonylamino)-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-(1H-indazole-3-carbonylamino)-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[1H-indazol-3-yl(oxo)methyl]amino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-(1H-indazole-3-carbonylamino)-4-methylsulfanylbutanoate Traditional Name: (2S)-2-(1H-indazole-3-carbonylamino)-4-(methylthio)butyrate Formula: C13H14N3O3S- MolecularWeight: 292.33356

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)[O-])NC(=O)C1=NNC2=CC=CC=C21

Isomeric SMILES

CSCC[C@@H](C(=O)[O-])NC(=O)C1=NNC2=CC=CC=C21

InChI

InChI=1S/C13H15N3O3S/c1-20-7-6-10(13(18)19)14-12(17)11-8-4-2-3-5-9(8)15-16-11/h2-5,10H,6-7H2,1H3,(H,14,17)(H,15,16)(H,18,19)/p-1/t10-/m0/s1