8-[[1,3-dimethyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]disulfanyl]-1,3-dimethyl-7H-purine-2,6-dione

Systemtic Name: 8-[[1,3-dimethyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]disulfanyl]-1,3-dimethyl-7H-purine-2,6-dione Openeye Name: 8-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)disulfanyl]-1,3-dimethyl-7H-purine-2,6-dione CAS Name: 8-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)disulfanyl]-1,3-dimethyl-7H-purine-2,6-dione IUPAC Name: 8-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)disulfanyl]-1,3-dimethyl-7H-purine-2,6-dione Traditional Name: 8-[(2,6-diketo-1,3-dimethyl-7H-purin-8-yl)disulfanyl]-1,3-dimethyl-7H-purine-2,6-quinone Formula: C14H14N8O4S2 MolecularWeight: 422.44216

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)SSC3=NC4=C(N3)C(=O)N(C(=O)N4C)C

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)SSC3=NC4=C(N3)C(=O)N(C(=O)N4C)C

InChI

InChI=1S/C14H14N8O4S2/c1-19-7-5(9(23)21(3)13(19)25)15-11(17-7)27-28-12-16-6-8(18-12)20(2)14(26)22(4)10(6)24/h1-4H3,(H,15,17)(H,16,18)