1-methyl-5-(thiophen-2-ylmethylcarbamoyl)pyrazole-4-carboxylate

Systemtic Name: 1-methyl-5-(thiophen-2-ylmethylcarbamoyl)pyrazole-4-carboxylate Openeye Name: 1-methyl-5-(2-thienylmethylcarbamoyl)pyrazole-4-carboxylate CAS Name: 1-methyl-5-[oxo-(thiophen-2-ylmethylamino)methyl]-4-pyrazolecarboxylate IUPAC Name: 1-methyl-5-(thiophen-2-ylmethylcarbamoyl)pyrazole-4-carboxylate Traditional Name: 1-methyl-5-(2-thenylcarbamoyl)pyrazole-4-carboxylate Formula: C11H10N3O3S- MolecularWeight: 264.2804

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)[O-])C(=O)NCC2=CC=CS2

Isomeric SMILES

CN1C(=C(C=N1)C(=O)[O-])C(=O)NCC2=CC=CS2

InChI

InChI=1S/C11H11N3O3S/c1-14-9(8(6-13-14)11(16)17)10(15)12-5-7-3-2-4-18-7/h2-4,6H,5H2,1H3,(H,12,15)(H,16,17)/p-1