(2S)-2-[(5-oxidanidyl-6-phenyl-1,2,4-triazin-3-yl)sulfanyl]propanoate

Systemtic Name: (2S)-2-[(5-oxidanidyl-6-phenyl-1,2,4-triazin-3-yl)sulfanyl]propanoate Openeye Name: (2S)-2-[(5-oxido-6-phenyl-1,2,4-triazin-3-yl)sulfanyl]propanoate CAS Name: (2S)-2-[(5-oxido-6-phenyl-1,2,4-triazin-3-yl)thio]propanoate IUPAC Name: (2S)-2-[(5-oxido-6-phenyl-1,2,4-triazin-3-yl)sulfanyl]propanoate Traditional Name: (2S)-2-[(5-oxido-6-phenyl-1,2,4-triazin-3-yl)thio]propionate Formula: C12H9N3O3S-2 MolecularWeight: 275.28316

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])SC1=NC(=C(N=N1)C2=CC=CC=C2)[O-]

Isomeric SMILES

C[C@@H](C(=O)[O-])SC1=NC(=C(N=N1)C2=CC=CC=C2)[O-]

InChI

InChI=1S/C12H11N3O3S/c1-7(11(17)18)19-12-13-10(16)9(14-15-12)8-5-3-2-4-6-8/h2-7H,1H3,(H,17,18)(H,13,15,16)/p-2/t7-/m0/s1