N-(3,5-dimethylphenyl)-4-[2-(3-ethynylphenyl)pyrazol-3-yl]pyrimidin-2-amine

Systemtic Name: N-(3,5-dimethylphenyl)-4-[2-(3-ethynylphenyl)pyrazol-3-yl]pyrimidin-2-amine Openeye Name: N-(3,5-dimethylphenyl)-4-[2-(3-ethynylphenyl)pyrazol-3-yl]pyrimidin-2-amine CAS Name: N-(3,5-dimethylphenyl)-4-[2-(3-ethynylphenyl)-3-pyrazolyl]-2-pyrimidinamine IUPAC Name: N-(3,5-dimethylphenyl)-4-[2-(3-ethynylphenyl)pyrazol-3-yl]pyrimidin-2-amine Traditional Name: (3,5-dimethylphenyl)-[4-[2-(3-ethynylphenyl)pyrazol-3-yl]pyrimidin-2-yl]amine Formula: C23H19N5 MolecularWeight: 365.43046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC2=NC=CC(=N2)C3=CC=NN3C4=CC=CC(=C4)C#C)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=NC=CC(=N2)C3=CC=NN3C4=CC=CC(=C4)C#C)C

InChI

InChI=1S/C23H19N5/c1-4-18-6-5-7-20(15-18)28-22(9-11-25-28)21-8-10-24-23(27-21)26-19-13-16(2)12-17(3)14-19/h1,5-15H,2-3H3,(H,24,26,27)