2-[4-[[butyl-[6-(4-methoxyphenyl)-5-methyl-pyrimidin-4-yl]amino]methyl]-2-methyl-phenoxy]ethanoate

Systemtic Name: 2-[4-[[butyl-[6-(4-methoxyphenyl)-5-methyl-pyrimidin-4-yl]amino]methyl]-2-methyl-phenoxy]ethanoate Openeye Name: 2-[4-[[butyl-[6-(4-methoxyphenyl)-5-methyl-pyrimidin-4-yl]amino]methyl]-2-methyl-phenoxy]acetate CAS Name: 2-[4-[[butyl-[6-(4-methoxyphenyl)-5-methyl-4-pyrimidinyl]amino]methyl]-2-methylphenoxy]acetate IUPAC Name: 2-[4-[[butyl-[6-(4-methoxyphenyl)-5-methylpyrimidin-4-yl]amino]methyl]-2-methylphenoxy]acetate Traditional Name: 2-[4-[[butyl-[6-(4-methoxyphenyl)-5-methyl-pyrimidin-4-yl]amino]methyl]-2-methyl-phenoxy]acetate Formula: C26H30N3O4- MolecularWeight: 448.5341

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC(=C(C=C1)OCC(=O)[O-])C)C2=NC=NC(=C2C)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCCN(CC1=CC(=C(C=C1)OCC(=O)[O-])C)C2=NC=NC(=C2C)C3=CC=C(C=C3)OC

InChI

InChI=1S/C26H31N3O4/c1-5-6-13-29(15-20-7-12-23(18(2)14-20)33-16-24(30)31)26-19(3)25(27-17-28-26)21-8-10-22(32-4)11-9-21/h7-12,14,17H,5-6,13,15-16H2,1-4H3,(H,30,31)/p-1