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

Systemtic Name: 1-[1,1-bis(oxidanylidene)thiolan-3-yl]-3-propan-2-yl-thieno[2,3-c]pyrazole-5-carboxylic acid Openeye Name: 1-(1,1-dioxothiolan-3-yl)-3-isopropyl-thieno[2,3-c]pyrazole-5-carboxylic acid CAS Name: 1-(1,1-dioxo-3-thiolanyl)-3-propan-2-yl-5-thieno[2,3-c]pyrazolecarboxylic acid IUPAC Name: 1-(1,1-dioxothiolan-3-yl)-3-propan-2-ylthieno[2,3-c]pyrazole-5-carboxylic acid Traditional Name: 1-(1,1-diketothiolan-3-yl)-3-isopropyl-thieno[2,3-c]pyrazole-5-carboxylic acid Formula: C13H16N2O4S2 MolecularWeight: 328.40714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN(C2=C1C=C(S2)C(=O)O)C3CCS(=O)(=O)C3

Isomeric SMILES

CC(C)C1=NN(C2=C1C=C(S2)C(=O)O)C3CCS(=O)(=O)C3

InChI

InChI=1S/C13H16N2O4S2/c1-7(2)11-9-5-10(13(16)17)20-12(9)15(14-11)8-3-4-21(18,19)6-8/h5,7-8H,3-4,6H2,1-2H3,(H,16,17)