N-[[2-[4,6-bis(trideuteriomethoxy)pyrimidin-2-yl]oxyphenyl]methyl]-2-bromanyl-aniline

Systemtic Name: N-[[2-[4,6-bis(trideuteriomethoxy)pyrimidin-2-yl]oxyphenyl]methyl]-2-bromanyl-aniline Openeye Name: N-[[2-[4,6-bis(trideuteriomethoxy)pyrimidin-2-yl]oxyphenyl]methyl]-2-bromo-aniline CAS Name: N-[[2-[[4,6-bis(trideuteriomethoxy)-2-pyrimidinyl]oxy]phenyl]methyl]-2-bromoaniline IUPAC Name: N-[[2-[4,6-bis(trideuteriomethoxy)pyrimidin-2-yl]oxyphenyl]methyl]-2-bromoaniline Traditional Name: [2-[4,6-bis(trideuteriomethoxy)pyrimidin-2-yl]oxybenzyl]-(2-bromophenyl)amine Formula: C19H18BrN3O3 MolecularWeight: 422.305491

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)OC2=CC=CC=C2CNC3=CC=CC=C3Br)OC

Isomeric SMILES

[2H]C([2H])([2H])OC1=CC(=NC(=N1)OC2=CC=CC=C2CNC3=CC=CC=C3Br)OC([2H])([2H])[2H]

InChI

InChI=1S/C19H18BrN3O3/c1-24-17-11-18(25-2)23-19(22-17)26-16-10-6-3-7-13(16)12-21-15-9-5-4-8-14(15)20/h3-11,21H,12H2,1-2H3/i1D3,2D3