6-[[(2S)-1-oxidanylidene-1-phenylmethoxy-propan-2-yl]amino]-3-sulfanylidene-2H-1,2,4-triazin-5-olate

Systemtic Name: 6-[[(2S)-1-oxidanylidene-1-phenylmethoxy-propan-2-yl]amino]-3-sulfanylidene-2H-1,2,4-triazin-5-olate Openeye Name: 6-[[(1S)-2-benzyloxy-1-methyl-2-oxo-ethyl]amino]-3-thioxo-2H-1,2,4-triazin-5-olate CAS Name: 6-[[(2S)-1-oxo-1-phenylmethoxypropan-2-yl]amino]-3-sulfanylidene-2H-1,2,4-triazin-5-olate IUPAC Name: 6-[[(2S)-1-oxo-1-phenylmethoxypropan-2-yl]amino]-3-sulfanylidene-2H-1,2,4-triazin-5-olate Traditional Name: 6-[[(1S)-2-benzoxy-2-keto-1-methyl-ethyl]amino]-3-thioxo-2H-1,2,4-triazin-5-olate Formula: C13H13N4O3S- MolecularWeight: 305.33232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC=CC=C1)NC2=NNC(=S)N=C2[O-]

Isomeric SMILES

C[C@@H](C(=O)OCC1=CC=CC=C1)NC2=NNC(=S)N=C2[O-]

InChI

InChI=1S/C13H14N4O3S/c1-8(14-10-11(18)15-13(21)17-16-10)12(19)20-7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,14,16)(H2,15,17,18,21)/p-1/t8-/m0/s1