1,7-dicyclopropyl-5-[(1R)-2-(diethylamino)-2-oxidanylidene-1-phenyl-ethyl]sulfanyl-4-oxidanylidene-pyrimido[4,5-d]pyrimidin-2-olate

Systemtic Name: 1,7-dicyclopropyl-5-[(1R)-2-(diethylamino)-2-oxidanylidene-1-phenyl-ethyl]sulfanyl-4-oxidanylidene-pyrimido[4,5-d]pyrimidin-2-olate Openeye Name: 1,7-dicyclopropyl-5-[(1R)-2-(diethylamino)-2-oxo-1-phenyl-ethyl]sulfanyl-4-oxo-pyrimido[4,5-d]pyrimidin-2-olate CAS Name: 1,7-dicyclopropyl-5-[[(1R)-2-(diethylamino)-2-oxo-1-phenylethyl]thio]-4-oxo-2-pyrimido[4,5-d]pyrimidinolate IUPAC Name: 1,7-dicyclopropyl-5-[(1R)-2-(diethylamino)-2-oxo-1-phenylethyl]sulfanyl-4-oxopyrimido[4,5-d]pyrimidin-2-olate Traditional Name: 1,7-dicyclopropyl-5-[[(1R)-2-(diethylamino)-2-keto-1-phenyl-ethyl]thio]-4-keto-pyrimido[4,5-d]pyrimidin-2-olate Formula: C24H26N5O3S- MolecularWeight: 464.55994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C(C1=CC=CC=C1)SC2=NC(=NC3=C2C(=O)N=C(N3C4CC4)[O-])C5CC5

Isomeric SMILES

CCN(CC)C(=O)[C@@H](C1=CC=CC=C1)SC2=NC(=NC3=C2C(=O)N=C(N3C4CC4)[O-])C5CC5

InChI

InChI=1S/C24H27N5O3S/c1-3-28(4-2)23(31)18(14-8-6-5-7-9-14)33-22-17-20(25-19(26-22)15-10-11-15)29(16-12-13-16)24(32)27-21(17)30/h5-9,15-16,18H,3-4,10-13H2,1-2H3,(H,27,30,32)/p-1/t18-/m1/s1