[4-[(6-phenylpyrimidin-4-yl)amino]phenyl] (E)-3-(4-ethoxyphenyl)prop-2-enoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=CC(=O)OC2=CC=C(C=C2)NC3=NC=NC(=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C/C(=O)OC2=CC=C(C=C2)NC3=NC=NC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H23N3O3/c1-2-32-23-13-8-20(9-14-23)10-17-27(31)33-24-15-11-22(12-16-24)30-26-18-25(28-19-29-26)21-6-4-3-5-7-21/h3-19H,2H2,1H3,(H,28,29,30)/b17-10+