1-(4,6-dimethylpyrimidin-2-yl)-5-pyrrol-1-yl-pyrazole-4-carboxylate

Systemtic Name: 1-(4,6-dimethylpyrimidin-2-yl)-5-pyrrol-1-yl-pyrazole-4-carboxylate Openeye Name: 1-(4,6-dimethylpyrimidin-2-yl)-5-pyrrol-1-yl-pyrazole-4-carboxylate CAS Name: 1-(4,6-dimethyl-2-pyrimidinyl)-5-(1-pyrrolyl)-4-pyrazolecarboxylate IUPAC Name: 1-(4,6-dimethylpyrimidin-2-yl)-5-pyrrol-1-ylpyrazole-4-carboxylate Traditional Name: 1-(4,6-dimethylpyrimidin-2-yl)-5-pyrrol-1-yl-pyrazole-4-carboxylate Formula: C14H12N5O2- MolecularWeight: 282.27738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C(=C(C=N2)C(=O)[O-])N3C=CC=C3)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2C(=C(C=N2)C(=O)[O-])N3C=CC=C3)C

InChI

InChI=1S/C14H13N5O2/c1-9-7-10(2)17-14(16-9)19-12(18-5-3-4-6-18)11(8-15-19)13(20)21/h3-8H,1-2H3,(H,20,21)/p-1