2-[2-[(2,5-dimethylpyrazol-3-yl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: 2-[2-[(2,5-dimethylpyrazol-3-yl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: 2-[2-[(2,5-dimethylpyrazol-3-yl)amino]-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-[(2,5-dimethyl-3-pyrazolyl)amino]-2-oxoethyl]thio]acetate IUPAC Name: 2-[2-[(2,5-dimethylpyrazol-3-yl)amino]-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-[(2,5-dimethylpyrazol-3-yl)amino]-2-keto-ethyl]thio]acetate Formula: C9H12N3O3S- MolecularWeight: 242.27488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)CSCC(=O)[O-])C

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)CSCC(=O)[O-])C

InChI

InChI=1S/C9H13N3O3S/c1-6-3-7(12(2)11-6)10-8(13)4-16-5-9(14)15/h3H,4-5H2,1-2H3,(H,10,13)(H,14,15)/p-1