7-cyclohexyl-1-ethyl-4-oxidanylidene-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate

Systemtic Name: 7-cyclohexyl-1-ethyl-4-oxidanylidene-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate Openeye Name: 7-cyclohexyl-1-ethyl-4-oxo-5-thioxo-8H-pyrimido[4,5-d]pyrimidin-2-olate CAS Name: 7-cyclohexyl-1-ethyl-4-oxo-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate IUPAC Name: 7-cyclohexyl-1-ethyl-4-oxo-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate Traditional Name: 7-cyclohexyl-1-ethyl-4-keto-5-thioxo-8H-pyrimido[4,5-d]pyrimidin-2-olate Formula: C14H17N4O2S- MolecularWeight: 305.37538

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=O)N=C1[O-])C(=S)N=C(N2)C3CCCCC3

Isomeric SMILES

CCN1C2=C(C(=O)N=C1[O-])C(=S)N=C(N2)C3CCCCC3

InChI

InChI=1S/C14H18N4O2S/c1-2-18-11-9(12(19)17-14(18)20)13(21)16-10(15-11)8-6-4-3-5-7-8/h8H,2-7H2,1H3,(H,15,16,21)(H,17,19,20)/p-1