2-(4,6-dimethylpyrimidin-2-yl)-5-thiophen-2-yl-pyrazole-3-carboxylate

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)-5-thiophen-2-yl-pyrazole-3-carboxylate Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)-5-(2-thienyl)pyrazole-3-carboxylate CAS Name: 2-(4,6-dimethyl-2-pyrimidinyl)-5-thiophen-2-yl-3-pyrazolecarboxylate IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)-5-thiophen-2-ylpyrazole-3-carboxylate Traditional Name: 2-(4,6-dimethylpyrimidin-2-yl)-5-(2-thienyl)pyrazole-3-carboxylate Formula: C14H11N4O2S- MolecularWeight: 299.32774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C(=CC(=N2)C3=CC=CS3)C(=O)[O-])C

Isomeric SMILES

CC1=CC(=NC(=N1)N2C(=CC(=N2)C3=CC=CS3)C(=O)[O-])C

InChI

InChI=1S/C14H12N4O2S/c1-8-6-9(2)16-14(15-8)18-11(13(19)20)7-10(17-18)12-4-3-5-21-12/h3-7H,1-2H3,(H,19,20)/p-1