2-[2-[[5-(4-chlorophenyl)-2-methyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: 2-[2-[[5-(4-chlorophenyl)-2-methyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: 2-[2-[[5-(4-chlorophenyl)-2-methyl-pyrazol-3-yl]amino]-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-[[5-(4-chlorophenyl)-2-methyl-3-pyrazolyl]amino]-2-oxoethyl]thio]acetate IUPAC Name: 2-[2-[[5-(4-chlorophenyl)-2-methylpyrazol-3-yl]amino]-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-[[5-(4-chlorophenyl)-2-methyl-pyrazol-3-yl]amino]-2-keto-ethyl]thio]acetate Formula: C14H13ClN3O3S- MolecularWeight: 338.78932

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=N1)C2=CC=C(C=C2)Cl)NC(=O)CSCC(=O)[O-]

Isomeric SMILES

CN1C(=CC(=N1)C2=CC=C(C=C2)Cl)NC(=O)CSCC(=O)[O-]

InChI

InChI=1S/C14H14ClN3O3S/c1-18-12(16-13(19)7-22-8-14(20)21)6-11(17-18)9-2-4-10(15)5-3-9/h2-6H,7-8H2,1H3,(H,16,19)(H,20,21)/p-1