methyl 1-ethyl-4-[3-(4-iodanyl-3-methyl-pyrazol-1-yl)propanoylamino]pyrazole-3-carboxylate

Systemtic Name: methyl 1-ethyl-4-[3-(4-iodanyl-3-methyl-pyrazol-1-yl)propanoylamino]pyrazole-3-carboxylate Openeye Name: methyl 1-ethyl-4-[3-(4-iodo-3-methyl-pyrazol-1-yl)propanoylamino]pyrazole-3-carboxylate CAS Name: 1-ethyl-4-[[3-(4-iodo-3-methyl-1-pyrazolyl)-1-oxopropyl]amino]-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1-ethyl-4-[3-(4-iodo-3-methylpyrazol-1-yl)propanoylamino]pyrazole-3-carboxylate Traditional Name: 1-ethyl-4-[3-(4-iodo-3-methyl-pyrazol-1-yl)propanoylamino]pyrazole-3-carboxylic acid methyl ester Formula: C14H18IN5O3 MolecularWeight: 431.22889

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)OC)NC(=O)CCN2C=C(C(=N2)C)I

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)OC)NC(=O)CCN2C=C(C(=N2)C)I

InChI

InChI=1S/C14H18IN5O3/c1-4-19-8-11(13(18-19)14(22)23-3)16-12(21)5-6-20-7-10(15)9(2)17-20/h7-8H,4-6H2,1-3H3,(H,16,21)