4-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-N-(4-piperazin-1-ylphenyl)pyrimidin-2-amine

Systemtic Name: 4-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-N-(4-piperazin-1-ylphenyl)pyrimidin-2-amine Openeye Name: 4-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-N-(4-piperazin-1-ylphenyl)pyrimidin-2-amine CAS Name: 4-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-N-[4-(1-piperazinyl)phenyl]-2-pyrimidinamine IUPAC Name: 4-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-N-(4-piperazin-1-ylphenyl)pyrimidin-2-amine Traditional Name: [4-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]pyrimidin-2-yl]-(4-piperazinophenyl)amine Formula: C23H22ClN7 MolecularWeight: 431.92068

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC=C(C=C2)NC3=NC=CC(=N3)C4=C(NN=C4)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CN(CCN1)C2=CC=C(C=C2)NC3=NC=CC(=N3)C4=C(NN=C4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C23H22ClN7/c24-17-3-1-16(2-4-17)22-20(15-27-30-22)21-9-10-26-23(29-21)28-18-5-7-19(8-6-18)31-13-11-25-12-14-31/h1-10,15,25H,11-14H2,(H,27,30)(H,26,28,29)