ethyl 2-methyl-5-(2-sulfanylethylcarbamoyl)pyrazole-3-carboxylate

Systemtic Name: ethyl 2-methyl-5-(2-sulfanylethylcarbamoyl)pyrazole-3-carboxylate Openeye Name: ethyl 2-methyl-5-(2-sulfanylethylcarbamoyl)pyrazole-3-carboxylate CAS Name: 5-[(2-mercaptoethylamino)-oxomethyl]-2-methyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-5-(2-sulfanylethylcarbamoyl)pyrazole-3-carboxylate Traditional Name: 5-(2-mercaptoethylcarbamoyl)-2-methyl-pyrazole-3-carboxylic acid ethyl ester Formula: C10H15N3O3S MolecularWeight: 257.3094

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NN1C)C(=O)NCCS

Isomeric SMILES

CCOC(=O)C1=CC(=NN1C)C(=O)NCCS

InChI

InChI=1S/C10H15N3O3S/c1-3-16-10(15)8-6-7(12-13(8)2)9(14)11-4-5-17/h6,17H,3-5H2,1-2H3,(H,11,14)