2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-7-oxidanylidene-4H-[1,3]thiazolo[4,5-d]pyrimidin-5-olate

Systemtic Name: 2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-7-oxidanylidene-4H-[1,3]thiazolo[4,5-d]pyrimidin-5-olate Openeye Name: 2-(3,3-dimethyl-2-oxo-butyl)sulfanyl-7-oxo-4H-thiazolo[4,5-d]pyrimidin-5-olate CAS Name: 2-[(3,3-dimethyl-2-oxobutyl)thio]-7-oxo-4H-thiazolo[4,5-d]pyrimidin-5-olate IUPAC Name: 2-(3,3-dimethyl-2-oxobutyl)sulfanyl-7-oxo-4H-[1,3]thiazolo[4,5-d]pyrimidin-5-olate Traditional Name: 7-keto-2-[(2-keto-3,3-dimethyl-butyl)thio]-4H-thiazolo[4,5-d]pyrimidin-5-olate Formula: C11H12N3O3S2- MolecularWeight: 298.36128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CSC1=NC2=C(S1)C(=O)N=C(N2)[O-]

Isomeric SMILES

CC(C)(C)C(=O)CSC1=NC2=C(S1)C(=O)N=C(N2)[O-]

InChI

InChI=1S/C11H13N3O3S2/c1-11(2,3)5(15)4-18-10-13-7-6(19-10)8(16)14-9(17)12-7/h4H2,1-3H3,(H2,12,14,16,17)/p-1