7-cyclohexyl-1-phenethyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione

Systemtic Name: 7-cyclohexyl-1-phenethyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 7-cyclohexyl-1-phenethyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 7-cyclohexyl-1-phenethyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 7-cyclohexyl-1-phenethyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 7-cyclohexyl-1-phenethyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C22H22F6N4O2 MolecularWeight: 488.426099

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NC(C3=C(N2)N(C(=O)NC3=O)CCC4=CC=CC=C4)(C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1CCC(CC1)C2=NC(C3=C(N2)N(C(=O)NC3=O)CCC4=CC=CC=C4)(C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C22H22F6N4O2/c23-21(24,25)20(22(26,27)28)15-17(29-16(31-20)14-9-5-2-6-10-14)32(19(34)30-18(15)33)12-11-13-7-3-1-4-8-13/h1,3-4,7-8,14H,2,5-6,9-12H2,(H,29,31)(H,30,33,34)