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

Systemtic Name: 4-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-N-[4-(4-ethylpiperazin-1-yl)phenyl]pyrimidin-2-amine Openeye Name: 4-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-N-[4-(4-ethylpiperazin-1-yl)phenyl]pyrimidin-2-amine CAS Name: 4-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-N-[4-(4-ethyl-1-piperazinyl)phenyl]-2-pyrimidinamine IUPAC Name: 4-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-N-[4-(4-ethylpiperazin-1-yl)phenyl]pyrimidin-2-amine Traditional Name: [4-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]pyrimidin-2-yl]-[4-(4-ethylpiperazino)phenyl]amine Formula: C25H26ClN7 MolecularWeight: 459.97384

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC=C(C=C2)NC3=NC=CC(=N3)C4=C(NN=C4)C5=CC=C(C=C5)Cl

Isomeric SMILES

CCN1CCN(CC1)C2=CC=C(C=C2)NC3=NC=CC(=N3)C4=C(NN=C4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C25H26ClN7/c1-2-32-13-15-33(16-14-32)21-9-7-20(8-10-21)29-25-27-12-11-23(30-25)22-17-28-31-24(22)18-3-5-19(26)6-4-18/h3-12,17H,2,13-16H2,1H3,(H,28,31)(H,27,29,30)