ethyl 2-[5-methyl-2-(methylcarbamothioyl)-3-oxidanylidene-1H-pyrazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[5-methyl-2-(methylcarbamothioyl)-3-oxidanylidene-1H-pyrazol-4-yl]ethanoate Openeye Name: ethyl 2-[5-methyl-2-(methylcarbamothioyl)-3-oxo-1H-pyrazol-4-yl]acetate CAS Name: 2-[5-methyl-2-[methylamino(sulfanylidene)methyl]-3-oxo-1H-pyrazol-4-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-methyl-2-(methylcarbamothioyl)-3-oxo-1H-pyrazol-4-yl]acetate Traditional Name: 2-[5-keto-3-methyl-1-(methylthiocarbamoyl)-3-pyrazolin-4-yl]acetic acid ethyl ester Formula: C10H15N3O3S MolecularWeight: 257.3094

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(NN(C1=O)C(=S)NC)C

Isomeric SMILES

CCOC(=O)CC1=C(NN(C1=O)C(=S)NC)C

InChI

InChI=1S/C10H15N3O3S/c1-4-16-8(14)5-7-6(2)12-13(9(7)15)10(17)11-3/h12H,4-5H2,1-3H3,(H,11,17)