1-cyclopropyl-4-oxidanylidene-7-propan-2-yl-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate

Systemtic Name: 1-cyclopropyl-4-oxidanylidene-7-propan-2-yl-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate Openeye Name: 1-cyclopropyl-7-isopropyl-4-oxo-5-thioxo-8H-pyrimido[4,5-d]pyrimidin-2-olate CAS Name: 1-cyclopropyl-4-oxo-7-propan-2-yl-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate IUPAC Name: 1-cyclopropyl-4-oxo-7-propan-2-yl-5-sulfanylidene-8H-pyrimido[4,5-d]pyrimidin-2-olate Traditional Name: 1-cyclopropyl-7-isopropyl-4-keto-5-thioxo-8H-pyrimido[4,5-d]pyrimidin-2-olate Formula: C12H13N4O2S- MolecularWeight: 277.32222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=S)C2=C(N1)N(C(=NC2=O)[O-])C3CC3

Isomeric SMILES

CC(C)C1=NC(=S)C2=C(N1)N(C(=NC2=O)[O-])C3CC3

InChI

InChI=1S/C12H14N4O2S/c1-5(2)8-13-9-7(11(19)14-8)10(17)15-12(18)16(9)6-3-4-6/h5-6H,3-4H2,1-2H3,(H,13,14,19)(H,15,17,18)/p-1