9-butyl-1,3-dimethyl-8-sulfanylidene-7H-purine-2,6-dione

Systemtic Name: 9-butyl-1,3-dimethyl-8-sulfanylidene-7H-purine-2,6-dione Openeye Name: 9-butyl-1,3-dimethyl-8-thioxo-7H-purine-2,6-dione CAS Name: 9-butyl-1,3-dimethyl-8-sulfanylidene-7H-purine-2,6-dione IUPAC Name: 9-butyl-1,3-dimethyl-8-sulfanylidene-7H-purine-2,6-dione Traditional Name: 9-butyl-1,3-dimethyl-8-thioxo-7H-purine-2,6-quinone Formula: C11H16N4O2S MolecularWeight: 268.33534

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)N(C(=O)N2C)C)NC1=S

Isomeric SMILES

CCCCN1C2=C(C(=O)N(C(=O)N2C)C)NC1=S

InChI

InChI=1S/C11H16N4O2S/c1-4-5-6-15-8-7(12-10(15)18)9(16)14(3)11(17)13(8)2/h4-6H2,1-3H3,(H,12,18)