1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-5-ethyl-pyrazole-4-carboxylate

Systemtic Name: 1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-5-ethyl-pyrazole-4-carboxylate Openeye Name: 1-[(3S)-1,1-dioxothiolan-3-yl]-5-ethyl-pyrazole-4-carboxylate CAS Name: 1-[(3S)-1,1-dioxo-3-thiolanyl]-5-ethyl-4-pyrazolecarboxylate IUPAC Name: 1-[(3S)-1,1-dioxothiolan-3-yl]-5-ethylpyrazole-4-carboxylate Traditional Name: 1-[(3S)-1,1-diketothiolan-3-yl]-5-ethyl-pyrazole-4-carboxylate Formula: C10H13N2O4S- MolecularWeight: 257.28622

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2CCS(=O)(=O)C2)C(=O)[O-]

Isomeric SMILES

CCC1=C(C=NN1[C@H]2CCS(=O)(=O)C2)C(=O)[O-]

InChI

InChI=1S/C10H14N2O4S/c1-2-9-8(10(13)14)5-11-12(9)7-3-4-17(15,16)6-7/h5,7H,2-4,6H2,1H3,(H,13,14)/p-1/t7-/m0/s1