methyl 4-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]benzoate

Systemtic Name: methyl 4-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]benzoate Openeye Name: methyl 4-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]benzoate CAS Name: 4-[[4-(2-phenyl-3-pyrazolyl)-2-pyrimidinyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]benzoate Traditional Name: 4-[[4-(2-phenylpyrazol-3-yl)pyrimidin-2-yl]amino]benzoic acid methyl ester Formula: C21H17N5O2 MolecularWeight: 371.39198

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC2=NC=CC(=N2)C3=CC=NN3C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC2=NC=CC(=N2)C3=CC=NN3C4=CC=CC=C4

InChI

InChI=1S/C21H17N5O2/c1-28-20(27)15-7-9-16(10-8-15)24-21-22-13-11-18(25-21)19-12-14-23-26(19)17-5-3-2-4-6-17/h2-14H,1H3,(H,22,24,25)