N-(4-methylphenyl)-4-[3-methyl-1-(3-phenylmethoxyphenyl)pyrazol-4-yl]pyrimidin-2-amine

Systemtic Name: N-(4-methylphenyl)-4-[3-methyl-1-(3-phenylmethoxyphenyl)pyrazol-4-yl]pyrimidin-2-amine Openeye Name: 4-[1-(3-benzyloxyphenyl)-3-methyl-pyrazol-4-yl]-N-(p-tolyl)pyrimidin-2-amine CAS Name: N-(4-methylphenyl)-4-[3-methyl-1-(3-phenylmethoxyphenyl)-4-pyrazolyl]-2-pyrimidinamine IUPAC Name: N-(4-methylphenyl)-4-[3-methyl-1-(3-phenylmethoxyphenyl)pyrazol-4-yl]pyrimidin-2-amine Traditional Name: [4-[1-(3-benzoxyphenyl)-3-methyl-pyrazol-4-yl]pyrimidin-2-yl]-(p-tolyl)amine Formula: C28H25N5O MolecularWeight: 447.531

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC=CC(=N2)C3=CN(N=C3C)C4=CC(=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC=CC(=N2)C3=CN(N=C3C)C4=CC(=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C28H25N5O/c1-20-11-13-23(14-12-20)30-28-29-16-15-27(31-28)26-18-33(32-21(26)2)24-9-6-10-25(17-24)34-19-22-7-4-3-5-8-22/h3-18H,19H2,1-2H3,(H,29,30,31)