4-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-N-(3,4,5-trimethoxyphenyl)pyrimidin-2-amine

Systemtic Name: 4-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-N-(3,4,5-trimethoxyphenyl)pyrimidin-2-amine Openeye Name: 4-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-N-(3,4,5-trimethoxyphenyl)pyrimidin-2-amine CAS Name: 4-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-N-(3,4,5-trimethoxyphenyl)-2-pyrimidinamine IUPAC Name: 4-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-N-(3,4,5-trimethoxyphenyl)pyrimidin-2-amine Traditional Name: [4-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]pyrimidin-2-yl]-(3,4,5-trimethoxyphenyl)amine Formula: C22H20ClN5O3 MolecularWeight: 437.8789

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC2=NC=CC(=N2)C3=C(NN=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC2=NC=CC(=N2)C3=C(NN=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H20ClN5O3/c1-29-18-10-15(11-19(30-2)21(18)31-3)26-22-24-9-8-17(27-22)16-12-25-28-20(16)13-4-6-14(23)7-5-13/h4-12H,1-3H3,(H,25,28)(H,24,26,27)