[4-[(6-methylpyrimidin-4-yl)amino]phenyl] (E)-3-(4-tert-butylphenyl)prop-2-enoate

Systemtic Name: [4-[(6-methylpyrimidin-4-yl)amino]phenyl] (E)-3-(4-tert-butylphenyl)prop-2-enoate Openeye Name: [4-[(6-methylpyrimidin-4-yl)amino]phenyl] (E)-3-(4-tert-butylphenyl)prop-2-enoate CAS Name: (E)-3-(4-tert-butylphenyl)-2-propenoic acid [4-[(6-methyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: [4-[(6-methylpyrimidin-4-yl)amino]phenyl] (E)-3-(4-tert-butylphenyl)prop-2-enoate Traditional Name: (E)-3-(4-tert-butylphenyl)acrylic acid [4-[(6-methylpyrimidin-4-yl)amino]phenyl] ester Formula: C24H25N3O2 MolecularWeight: 387.4742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H25N3O2/c1-17-15-22(26-16-25-17)27-20-10-12-21(13-11-20)29-23(28)14-7-18-5-8-19(9-6-18)24(2,3)4/h5-16H,1-4H3,(H,25,26,27)/b14-7+