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

Systemtic Name: 7-cyclopentyl-1-(2-methoxyethyl)-4-oxidanylidene-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate Openeye Name: 7-cyclopentyl-1-(2-methoxyethyl)-4-oxo-5-thioxo-8H-pyrimido[4,5-d]pyrimidin-2-olate CAS Name: 7-cyclopentyl-1-(2-methoxyethyl)-4-oxo-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate IUPAC Name: 7-cyclopentyl-1-(2-methoxyethyl)-4-oxo-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate Traditional Name: 7-cyclopentyl-4-keto-1-(2-methoxyethyl)-5-thioxo-8H-pyrimido[4,5-d]pyrimidin-2-olate Formula: C14H17N4O3S- MolecularWeight: 321.37478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=C(C(=O)N=C1[O-])C(=S)N=C(N2)C3CCCC3

Isomeric SMILES

COCCN1C2=C(C(=O)N=C1[O-])C(=S)N=C(N2)C3CCCC3

InChI

InChI=1S/C14H18N4O3S/c1-21-7-6-18-11-9(12(19)17-14(18)20)13(22)16-10(15-11)8-4-2-3-5-8/h8H,2-7H2,1H3,(H,15,16,22)(H,17,19,20)/p-1