1-(4,6-dimethylpyrimidin-2-yl)-5-(2,5-dimethylpyrrol-1-yl)pyrazole-4-carboxylic acid

Systemtic Name: 1-(4,6-dimethylpyrimidin-2-yl)-5-(2,5-dimethylpyrrol-1-yl)pyrazole-4-carboxylic acid Openeye Name: 1-(4,6-dimethylpyrimidin-2-yl)-5-(2,5-dimethylpyrrol-1-yl)pyrazole-4-carboxylic acid CAS Name: 1-(4,6-dimethyl-2-pyrimidinyl)-5-(2,5-dimethyl-1-pyrrolyl)-4-pyrazolecarboxylic acid IUPAC Name: 1-(4,6-dimethylpyrimidin-2-yl)-5-(2,5-dimethylpyrrol-1-yl)pyrazole-4-carboxylic acid Traditional Name: 1-(4,6-dimethylpyrimidin-2-yl)-5-(2,5-dimethylpyrrol-1-yl)pyrazole-4-carboxylic acid Formula: C16H17N5O2 MolecularWeight: 311.33848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=C(C=NN2C3=NC(=CC(=N3)C)C)C(=O)O)C

Isomeric SMILES

CC1=CC=C(N1C2=C(C=NN2C3=NC(=CC(=N3)C)C)C(=O)O)C

InChI

InChI=1S/C16H17N5O2/c1-9-7-10(2)19-16(18-9)21-14(13(8-17-21)15(22)23)20-11(3)5-6-12(20)4/h5-8H,1-4H3,(H,22,23)