N-(3,5-dimethoxyphenyl)-4-[3-methyl-1-(phenylmethyl)pyrazol-4-yl]pyrimidin-2-amine

Systemtic Name: N-(3,5-dimethoxyphenyl)-4-[3-methyl-1-(phenylmethyl)pyrazol-4-yl]pyrimidin-2-amine Openeye Name: 4-(1-benzyl-3-methyl-pyrazol-4-yl)-N-(3,5-dimethoxyphenyl)pyrimidin-2-amine CAS Name: N-(3,5-dimethoxyphenyl)-4-[3-methyl-1-(phenylmethyl)-4-pyrazolyl]-2-pyrimidinamine IUPAC Name: 4-(1-benzyl-3-methylpyrazol-4-yl)-N-(3,5-dimethoxyphenyl)pyrimidin-2-amine Traditional Name: [4-(1-benzyl-3-methyl-pyrazol-4-yl)pyrimidin-2-yl]-(3,5-dimethoxyphenyl)amine Formula: C23H23N5O2 MolecularWeight: 401.46102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C2=NC(=NC=C2)NC3=CC(=CC(=C3)OC)OC)CC4=CC=CC=C4

Isomeric SMILES

CC1=NN(C=C1C2=NC(=NC=C2)NC3=CC(=CC(=C3)OC)OC)CC4=CC=CC=C4

InChI

InChI=1S/C23H23N5O2/c1-16-21(15-28(27-16)14-17-7-5-4-6-8-17)22-9-10-24-23(26-22)25-18-11-19(29-2)13-20(12-18)30-3/h4-13,15H,14H2,1-3H3,(H,24,25,26)