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

Systemtic Name: 2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-phenyl-4H-pyrazol-3-one Openeye Name: 2-(1,1-dioxothiolan-3-yl)-5-phenyl-4H-pyrazol-3-one CAS Name: 2-(1,1-dioxo-3-thiolanyl)-5-phenyl-4H-pyrazol-3-one IUPAC Name: 2-(1,1-dioxothiolan-3-yl)-5-phenyl-4H-pyrazol-3-one Traditional Name: 2-(1,1-diketothiolan-3-yl)-5-phenyl-2-pyrazolin-3-one Formula: C13H14N2O3S MolecularWeight: 278.32686

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1N2C(=O)CC(=N2)C3=CC=CC=C3

Isomeric SMILES

C1CS(=O)(=O)CC1N2C(=O)CC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C13H14N2O3S/c16-13-8-12(10-4-2-1-3-5-10)14-15(13)11-6-7-19(17,18)9-11/h1-5,11H,6-9H2