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

Systemtic Name: 7-cyclopentyl-1-(2-methylpropyl)-4-oxidanylidene-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate Openeye Name: 7-cyclopentyl-1-isobutyl-4-oxo-5-thioxo-8H-pyrimido[4,5-d]pyrimidin-2-olate CAS Name: 7-cyclopentyl-1-(2-methylpropyl)-4-oxo-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate IUPAC Name: 7-cyclopentyl-1-(2-methylpropyl)-4-oxo-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate Traditional Name: 7-cyclopentyl-1-isobutyl-4-keto-5-thioxo-8H-pyrimido[4,5-d]pyrimidin-2-olate Formula: C15H19N4O2S- MolecularWeight: 319.40196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C(=O)N=C1[O-])C(=S)N=C(N2)C3CCCC3

Isomeric SMILES

CC(C)CN1C2=C(C(=O)N=C1[O-])C(=S)N=C(N2)C3CCCC3

InChI

InChI=1S/C15H20N4O2S/c1-8(2)7-19-12-10(13(20)18-15(19)21)14(22)17-11(16-12)9-5-3-4-6-9/h8-9H,3-7H2,1-2H3,(H,16,17,22)(H,18,20,21)/p-1