4-(2-azanyl-2-phenyl-ethyl)-2-(2-chlorophenyl)-6-[[2-fluoranyl-6-(trifluoromethyl)phenyl]methyl]-1,2,4-triazine-3,5-dione

Systemtic Name: 4-(2-azanyl-2-phenyl-ethyl)-2-(2-chlorophenyl)-6-[[2-fluoranyl-6-(trifluoromethyl)phenyl]methyl]-1,2,4-triazine-3,5-dione Openeye Name: 4-(2-amino-2-phenyl-ethyl)-2-(2-chlorophenyl)-6-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-1,2,4-triazine-3,5-dione CAS Name: 4-(2-amino-2-phenylethyl)-2-(2-chlorophenyl)-6-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-1,2,4-triazine-3,5-dione IUPAC Name: 4-(2-amino-2-phenylethyl)-2-(2-chlorophenyl)-6-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-1,2,4-triazine-3,5-dione Traditional Name: 4-(2-amino-2-phenyl-ethyl)-2-(2-chlorophenyl)-6-[2-fluoro-6-(trifluoromethyl)benzyl]-1,2,4-triazine-3,5-quinone Formula: C25H19ClF4N4O2 MolecularWeight: 518.890573

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CN2C(=O)C(=NN(C2=O)C3=CC=CC=C3Cl)CC4=C(C=CC=C4F)C(F)(F)F)N

Isomeric SMILES

C1=CC=C(C=C1)C(CN2C(=O)C(=NN(C2=O)C3=CC=CC=C3Cl)CC4=C(C=CC=C4F)C(F)(F)F)N

InChI

InChI=1S/C25H19ClF4N4O2/c26-18-10-4-5-12-22(18)34-24(36)33(14-20(31)15-7-2-1-3-8-15)23(35)21(32-34)13-16-17(25(28,29)30)9-6-11-19(16)27/h1-12,20H,13-14,31H2