2-tert-butyl-4,4-bis(oxidanyl)-5-thiophen-2-yl-pyrazol-3-one

Systemtic Name: 2-tert-butyl-4,4-bis(oxidanyl)-5-thiophen-2-yl-pyrazol-3-one Openeye Name: 2-tert-butyl-4,4-dihydroxy-5-(2-thienyl)pyrazol-3-one CAS Name: 2-tert-butyl-4,4-dihydroxy-5-thiophen-2-yl-3-pyrazolone IUPAC Name: 2-tert-butyl-4,4-dihydroxy-5-thiophen-2-ylpyrazol-3-one Traditional Name: 2-tert-butyl-4,4-dihydroxy-5-(2-thienyl)-2-pyrazolin-3-one Formula: C11H14N2O3S MolecularWeight: 254.30546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=O)C(C(=N1)C2=CC=CS2)(O)O

Isomeric SMILES

CC(C)(C)N1C(=O)C(C(=N1)C2=CC=CS2)(O)O

InChI

InChI=1S/C11H14N2O3S/c1-10(2,3)13-9(14)11(15,16)8(12-13)7-5-4-6-17-7/h4-6,15-16H,1-3H3