2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-3,7-dihydropurin-6-one

Systemtic Name: 2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-3,7-dihydropurin-6-one Openeye Name: 2-(3,3-dimethyl-2-oxo-butyl)sulfanyl-3,7-dihydropurin-6-one CAS Name: 2-[(3,3-dimethyl-2-oxobutyl)thio]-3,7-dihydropurin-6-one IUPAC Name: 2-(3,3-dimethyl-2-oxobutyl)sulfanyl-3,7-dihydropurin-6-one Traditional Name: 2-[(2-keto-3,3-dimethyl-butyl)thio]-3,7-dihydropurin-6-one Formula: C11H14N4O2S MolecularWeight: 266.31946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CSC1=NC(=O)C2=C(N1)N=CN2

Isomeric SMILES

CC(C)(C)C(=O)CSC1=NC(=O)C2=C(N1)N=CN2

InChI

InChI=1S/C11H14N4O2S/c1-11(2,3)6(16)4-18-10-14-8-7(9(17)15-10)12-5-13-8/h5H,4H2,1-3H3,(H2,12,13,14,15,17)