2-[2-oxidanylidene-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl]sulfanylethanoic acid

Systemtic Name: 2-[2-oxidanylidene-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl]sulfanylethanoic acid Openeye Name: 2-[2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl]sulfanylacetic acid CAS Name: 2-[[2-oxo-2-[(1,3,5-trimethyl-4-pyrazolyl)amino]ethyl]thio]acetic acid IUPAC Name: 2-[2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl]sulfanylacetic acid Traditional Name: 2-[[2-keto-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl]thio]acetic acid Formula: C10H15N3O3S MolecularWeight: 257.3094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC(=O)CSCC(=O)O

Isomeric SMILES

CC1=C(C(=NN1C)C)NC(=O)CSCC(=O)O

InChI

InChI=1S/C10H15N3O3S/c1-6-10(7(2)13(3)12-6)11-8(14)4-17-5-9(15)16/h4-5H2,1-3H3,(H,11,14)(H,15,16)