1-methyl-3-thiomorpholin-4-ylcarbonyl-pyrazole-4-carboxylate

Systemtic Name: 1-methyl-3-thiomorpholin-4-ylcarbonyl-pyrazole-4-carboxylate Openeye Name: 1-methyl-3-(thiomorpholine-4-carbonyl)pyrazole-4-carboxylate CAS Name: 1-methyl-3-[oxo(thiomorpholin-4-yl)methyl]-4-pyrazolecarboxylate IUPAC Name: 1-methyl-3-(thiomorpholine-4-carbonyl)pyrazole-4-carboxylate Traditional Name: 1-methyl-3-(thiomorpholine-4-carbonyl)pyrazole-4-carboxylate Formula: C10H12N3O3S- MolecularWeight: 254.28558

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)N2CCSCC2)C(=O)[O-]

Isomeric SMILES

CN1C=C(C(=N1)C(=O)N2CCSCC2)C(=O)[O-]

InChI

InChI=1S/C10H13N3O3S/c1-12-6-7(10(15)16)8(11-12)9(14)13-2-4-17-5-3-13/h6H,2-5H2,1H3,(H,15,16)/p-1