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

Systemtic Name: 7-butan-2-yl-8-[[7-butan-2-yl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-8-yl]sulfanylmethylsulfanyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 8-[(1,3-dimethyl-2,6-dioxo-7-sec-butyl-purin-8-yl)sulfanylmethylsulfanyl]-1,3-dimethyl-7-sec-butyl-purine-2,6-dione CAS Name: 7-butan-2-yl-8-[[(7-butan-2-yl-1,3-dimethyl-2,6-dioxo-8-purinyl)thio]methylthio]-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-butan-2-yl-8-[(7-butan-2-yl-1,3-dimethyl-2,6-dioxopurin-8-yl)sulfanylmethylsulfanyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 8-[[(2,6-diketo-1,3-dimethyl-7-sec-butyl-purin-8-yl)thio]methylthio]-1,3-dimethyl-7-sec-butyl-xanthine Formula: C23H32N8O4S2 MolecularWeight: 548.68138

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C2=C(N=C1SCSC3=NC4=C(N3C(C)CC)C(=O)N(C(=O)N4C)C)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CCC(C)N1C2=C(N=C1SCSC3=NC4=C(N3C(C)CC)C(=O)N(C(=O)N4C)C)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C23H32N8O4S2/c1-9-12(3)30-14-16(26(5)22(34)28(7)18(14)32)24-20(30)36-11-37-21-25-17-15(31(21)13(4)10-2)19(33)29(8)23(35)27(17)6/h12-13H,9-11H2,1-8H3