2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-tert-butyl-4H-pyrazol-3-one

Systemtic Name: 2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-tert-butyl-4H-pyrazol-3-one Openeye Name: 5-tert-butyl-2-(1,1-dioxothiolan-3-yl)-4H-pyrazol-3-one CAS Name: 5-tert-butyl-2-(1,1-dioxo-3-thiolanyl)-4H-pyrazol-3-one IUPAC Name: 5-tert-butyl-2-(1,1-dioxothiolan-3-yl)-4H-pyrazol-3-one Traditional Name: 5-tert-butyl-2-(1,1-diketothiolan-3-yl)-2-pyrazolin-3-one Formula: C11H18N2O3S MolecularWeight: 258.33722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=O)C1)C2CCS(=O)(=O)C2

Isomeric SMILES

CC(C)(C)C1=NN(C(=O)C1)C2CCS(=O)(=O)C2

InChI

InChI=1S/C11H18N2O3S/c1-11(2,3)9-6-10(14)13(12-9)8-4-5-17(15,16)7-8/h8H,4-7H2,1-3H3