ethyl 3-(2-carbamothioyl-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl)propanoate

Systemtic Name: ethyl 3-(2-carbamothioyl-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl)propanoate Openeye Name: ethyl 3-(2-carbamothioyl-5-methyl-3-oxo-1H-pyrazol-4-yl)propanoate CAS Name: 3-(2-carbamothioyl-5-methyl-3-oxo-1H-pyrazol-4-yl)propanoic acid ethyl ester IUPAC Name: ethyl 3-(2-carbamothioyl-5-methyl-3-oxo-1H-pyrazol-4-yl)propanoate Traditional Name: 3-(5-keto-3-methyl-1-thiocarbamoyl-3-pyrazolin-4-yl)propionic acid ethyl ester Formula: C10H15N3O3S MolecularWeight: 257.3094

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=C(NN(C1=O)C(=S)N)C

Isomeric SMILES

CCOC(=O)CCC1=C(NN(C1=O)C(=S)N)C

InChI

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