2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-5-oxidanyl-4H-[1,3]thiazolo[4,5-b]pyridin-7-one

Systemtic Name: 2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-5-oxidanyl-4H-[1,3]thiazolo[4,5-b]pyridin-7-one Openeye Name: 2-(3,3-dimethyl-2-oxo-butyl)sulfanyl-5-hydroxy-4H-thiazolo[4,5-b]pyridin-7-one CAS Name: 2-[(3,3-dimethyl-2-oxobutyl)thio]-5-hydroxy-4H-thiazolo[4,5-b]pyridin-7-one IUPAC Name: 2-(3,3-dimethyl-2-oxobutyl)sulfanyl-5-hydroxy-4H-[1,3]thiazolo[4,5-b]pyridin-7-one Traditional Name: 5-hydroxy-2-[(2-keto-3,3-dimethyl-butyl)thio]-4H-thiazolo[4,5-b]pyridin-7-one Formula: C12H14N2O3S2 MolecularWeight: 298.38116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CSC1=NC2=C(S1)C(=O)C=C(N2)O

Isomeric SMILES

CC(C)(C)C(=O)CSC1=NC2=C(S1)C(=O)C=C(N2)O

InChI

InChI=1S/C12H14N2O3S2/c1-12(2,3)7(16)5-18-11-14-10-9(19-11)6(15)4-8(17)13-10/h4H,5H2,1-3H3,(H2,13,15,17)