7-[(2S)-2-ethylhexyl]-1,3-dimethyl-8-sulfanylidene-9H-purine-2,6-dione

Systemtic Name: 7-[(2S)-2-ethylhexyl]-1,3-dimethyl-8-sulfanylidene-9H-purine-2,6-dione Openeye Name: 7-[(2S)-2-ethylhexyl]-1,3-dimethyl-8-thioxo-9H-purine-2,6-dione CAS Name: 7-[(2S)-2-ethylhexyl]-1,3-dimethyl-8-sulfanylidene-9H-purine-2,6-dione IUPAC Name: 7-[(2S)-2-ethylhexyl]-1,3-dimethyl-8-sulfanylidene-9H-purine-2,6-dione Traditional Name: 7-[(2S)-2-ethylhexyl]-1,3-dimethyl-8-thioxo-9H-purine-2,6-quinone Formula: C15H24N4O2S MolecularWeight: 324.44166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CN1C2=C(NC1=S)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CCCC[C@H](CC)CN1C2=C(NC1=S)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C15H24N4O2S/c1-5-7-8-10(6-2)9-19-11-12(16-14(19)22)17(3)15(21)18(4)13(11)20/h10H,5-9H2,1-4H3,(H,16,22)/t10-/m0/s1