ethyl 4-[[2-(3,5-dimethylpyrazol-1-yl)-6-methyl-pyrimidin-4-yl]amino]benzoate

Systemtic Name: ethyl 4-[[2-(3,5-dimethylpyrazol-1-yl)-6-methyl-pyrimidin-4-yl]amino]benzoate Openeye Name: ethyl 4-[[2-(3,5-dimethylpyrazol-1-yl)-6-methyl-pyrimidin-4-yl]amino]benzoate CAS Name: 4-[[2-(3,5-dimethyl-1-pyrazolyl)-6-methyl-4-pyrimidinyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(3,5-dimethylpyrazol-1-yl)-6-methylpyrimidin-4-yl]amino]benzoate Traditional Name: 4-[[2-(3,5-dimethylpyrazol-1-yl)-6-methyl-pyrimidin-4-yl]amino]benzoic acid ethyl ester Formula: C19H21N5O2 MolecularWeight: 351.40234

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC2=NC(=NC(=C2)C)N3C(=CC(=N3)C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC2=NC(=NC(=C2)C)N3C(=CC(=N3)C)C

InChI

InChI=1S/C19H21N5O2/c1-5-26-18(25)15-6-8-16(9-7-15)21-17-11-12(2)20-19(22-17)24-14(4)10-13(3)23-24/h6-11H,5H2,1-4H3,(H,20,21,22)