ethyl 3-[[4-[5-(4-chloranyl-3-methoxy-phenyl)-1H-pyrazol-4-yl]pyrimidin-2-yl]amino]benzoate

Systemtic Name: ethyl 3-[[4-[5-(4-chloranyl-3-methoxy-phenyl)-1H-pyrazol-4-yl]pyrimidin-2-yl]amino]benzoate Openeye Name: ethyl 3-[[4-[5-(4-chloro-3-methoxy-phenyl)-1H-pyrazol-4-yl]pyrimidin-2-yl]amino]benzoate CAS Name: 3-[[4-[5-(4-chloro-3-methoxyphenyl)-1H-pyrazol-4-yl]-2-pyrimidinyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[4-[5-(4-chloro-3-methoxyphenyl)-1H-pyrazol-4-yl]pyrimidin-2-yl]amino]benzoate Traditional Name: 3-[[4-[5-(4-chloro-3-methoxy-phenyl)-1H-pyrazol-4-yl]pyrimidin-2-yl]amino]benzoic acid ethyl ester Formula: C23H20ClN5O3 MolecularWeight: 449.8896

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC2=NC=CC(=N2)C3=C(NN=C3)C4=CC(=C(C=C4)Cl)OC

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC2=NC=CC(=N2)C3=C(NN=C3)C4=CC(=C(C=C4)Cl)OC

InChI

InChI=1S/C23H20ClN5O3/c1-3-32-22(30)15-5-4-6-16(11-15)27-23-25-10-9-19(28-23)17-13-26-29-21(17)14-7-8-18(24)20(12-14)31-2/h4-13H,3H2,1-2H3,(H,26,29)(H,25,27,28)