1,7-bis(2-methylpropyl)-4-oxidanylidene-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate

Systemtic Name: 1,7-bis(2-methylpropyl)-4-oxidanylidene-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate Openeye Name: 1,7-diisobutyl-4-oxo-5-thioxo-8H-pyrimido[4,5-d]pyrimidin-2-olate CAS Name: 1,7-bis(2-methylpropyl)-4-oxo-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate IUPAC Name: 1,7-bis(2-methylpropyl)-4-oxo-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate Traditional Name: 1,7-diisobutyl-4-keto-5-thioxo-8H-pyrimido[4,5-d]pyrimidin-2-olate Formula: C14H19N4O2S- MolecularWeight: 307.39126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NC(=S)C2=C(N1)N(C(=NC2=O)[O-])CC(C)C

Isomeric SMILES

CC(C)CC1=NC(=S)C2=C(N1)N(C(=NC2=O)[O-])CC(C)C

InChI

InChI=1S/C14H20N4O2S/c1-7(2)5-9-15-11-10(13(21)16-9)12(19)17-14(20)18(11)6-8(3)4/h7-8H,5-6H2,1-4H3,(H,15,16,21)(H,17,19,20)/p-1