N-[4-(dimethylaminomethyl)phenyl]-4-[5-(3-phenylmethoxyphenyl)-1H-pyrazol-4-yl]pyrimidin-2-amine

Systemtic Name: N-[4-(dimethylaminomethyl)phenyl]-4-[5-(3-phenylmethoxyphenyl)-1H-pyrazol-4-yl]pyrimidin-2-amine Openeye Name: 4-[5-(3-benzyloxyphenyl)-1H-pyrazol-4-yl]-N-[4-(dimethylaminomethyl)phenyl]pyrimidin-2-amine CAS Name: N-[4-(dimethylaminomethyl)phenyl]-4-[5-(3-phenylmethoxyphenyl)-1H-pyrazol-4-yl]-2-pyrimidinamine IUPAC Name: N-[4-(dimethylaminomethyl)phenyl]-4-[5-(3-phenylmethoxyphenyl)-1H-pyrazol-4-yl]pyrimidin-2-amine Traditional Name: [4-[[4-[5-(3-benzoxyphenyl)-1H-pyrazol-4-yl]pyrimidin-2-yl]amino]benzyl]-dimethyl-amine Formula: C29H28N6O MolecularWeight: 476.57222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H28N6O/c1-35(2)19-21-11-13-24(14-12-21)32-29-30-16-15-27(33-29)26-18-31-34-28(26)23-9-6-10-25(17-23)36-20-22-7-4-3-5-8-22/h3-18H,19-20H2,1-2H3,(H,31,34)(H,30,32,33)