2-tert-butyl-1-oxidanylidene-5-phenyl-1,2-thiazol-3-one

Systemtic Name: 2-tert-butyl-1-oxidanylidene-5-phenyl-1,2-thiazol-3-one Openeye Name: 2-tert-butyl-1-oxo-5-phenyl-isothiazol-3-one CAS Name: 2-tert-butyl-1-oxo-5-phenyl-3-isothiazolone IUPAC Name: 2-tert-butyl-1-oxo-5-phenyl-1,2-thiazol-3-one Traditional Name: 2-tert-butyl-1-keto-5-phenyl-isothiazol-3-one Formula: C13H15NO2S MolecularWeight: 249.3287

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=O)C=C(S1=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)N1C(=O)C=C(S1=O)C2=CC=CC=C2

InChI

InChI=1S/C13H15NO2S/c1-13(2,3)14-12(15)9-11(17(14)16)10-7-5-4-6-8-10/h4-9H,1-3H3