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

Systemtic Name: ethyl 2-(2-carbamothioyl-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl)ethanoate Openeye Name: ethyl 2-(2-carbamothioyl-5-methyl-3-oxo-1H-pyrazol-4-yl)acetate CAS Name: 2-(2-carbamothioyl-5-methyl-3-oxo-1H-pyrazol-4-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-(2-carbamothioyl-5-methyl-3-oxo-1H-pyrazol-4-yl)acetate Traditional Name: 2-(5-keto-3-methyl-1-thiocarbamoyl-3-pyrazolin-4-yl)acetic acid ethyl ester Formula: C9H13N3O3S MolecularWeight: 243.28282

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H13N3O3S/c1-3-15-7(13)4-6-5(2)11-12(8(6)14)9(10)16/h11H,3-4H2,1-2H3,(H2,10,16)