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

Systemtic Name: 1-(4-methoxyphenyl)-7-methyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 1-(4-methoxyphenyl)-7-methyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 1-(4-methoxyphenyl)-7-methyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 1-(4-methoxyphenyl)-7-methyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 1-(4-methoxyphenyl)-7-methyl-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C16H12F6N4O3 MolecularWeight: 422.281899

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(C2=C(N1)N(C(=O)NC2=O)C3=CC=C(C=C3)OC)(C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC1=NC(C2=C(N1)N(C(=O)NC2=O)C3=CC=C(C=C3)OC)(C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C16H12F6N4O3/c1-7-23-11-10(14(25-7,15(17,18)19)16(20,21)22)12(27)24-13(28)26(11)8-3-5-9(29-2)6-4-8/h3-6H,1-2H3,(H,23,25)(H,24,27,28)