[3-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] (E)-3-(4-methoxyphenyl)prop-2-enoate

Systemtic Name: [3-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] (E)-3-(4-methoxyphenyl)prop-2-enoate Openeye Name: [3-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] (E)-3-(4-methoxyphenyl)prop-2-enoate CAS Name: (E)-3-(4-methoxyphenyl)-2-propenoic acid [3-[(2-methyl-6-phenyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: [3-[(2-methyl-6-phenylpyrimidin-4-yl)amino]phenyl] (E)-3-(4-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(4-methoxyphenyl)acrylic acid [3-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] ester Formula: C27H23N3O3 MolecularWeight: 437.48982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NC2=CC(=CC=C2)OC(=O)C=CC3=CC=C(C=C3)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=NC(=CC(=N1)NC2=CC(=CC=C2)OC(=O)/C=C/C3=CC=C(C=C3)OC)C4=CC=CC=C4

InChI

InChI=1S/C27H23N3O3/c1-19-28-25(21-7-4-3-5-8-21)18-26(29-19)30-22-9-6-10-24(17-22)33-27(31)16-13-20-11-14-23(32-2)15-12-20/h3-18H,1-2H3,(H,28,29,30)/b16-13+