1-[1,1-bis(oxidanylidene)thiolan-3-yl]-3-ethyl-thieno[2,3-c]pyrazole-5-carboxylic acid

Systemtic Name: 1-[1,1-bis(oxidanylidene)thiolan-3-yl]-3-ethyl-thieno[2,3-c]pyrazole-5-carboxylic acid Openeye Name: 1-(1,1-dioxothiolan-3-yl)-3-ethyl-thieno[2,3-c]pyrazole-5-carboxylic acid CAS Name: 1-(1,1-dioxo-3-thiolanyl)-3-ethyl-5-thieno[2,3-c]pyrazolecarboxylic acid IUPAC Name: 1-(1,1-dioxothiolan-3-yl)-3-ethylthieno[2,3-c]pyrazole-5-carboxylic acid Traditional Name: 1-(1,1-diketothiolan-3-yl)-3-ethyl-thieno[2,3-c]pyrazole-5-carboxylic acid Formula: C12H14N2O4S2 MolecularWeight: 314.38056

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C2=C1C=C(S2)C(=O)O)C3CCS(=O)(=O)C3

Isomeric SMILES

CCC1=NN(C2=C1C=C(S2)C(=O)O)C3CCS(=O)(=O)C3

InChI

InChI=1S/C12H14N2O4S2/c1-2-9-8-5-10(12(15)16)19-11(8)14(13-9)7-3-4-20(17,18)6-7/h5,7H,2-4,6H2,1H3,(H,15,16)