7-(2,2-dimethylpropyl)-1-ethyl-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidine-2,4-dione

Systemtic Name: 7-(2,2-dimethylpropyl)-1-ethyl-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 7-(2,2-dimethylpropyl)-1-ethyl-5-thioxo-8H-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 7-(2,2-dimethylpropyl)-1-ethyl-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 7-(2,2-dimethylpropyl)-1-ethyl-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 1-ethyl-7-neopentyl-5-thioxo-8H-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C13H18N4O2S MolecularWeight: 294.37262

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=O)NC1=O)C(=S)N=C(N2)CC(C)(C)C

Isomeric SMILES

CCN1C2=C(C(=O)NC1=O)C(=S)N=C(N2)CC(C)(C)C

InChI

InChI=1S/C13H18N4O2S/c1-5-17-9-8(10(18)16-12(17)19)11(20)15-7(14-9)6-13(2,3)4/h5-6H2,1-4H3,(H,14,15,20)(H,16,18,19)