propan-2-yl 4-[3-(4-chloranylpyrazol-1-yl)propanoylamino]-1-ethyl-pyrazole-3-carboxylate

Systemtic Name: propan-2-yl 4-[3-(4-chloranylpyrazol-1-yl)propanoylamino]-1-ethyl-pyrazole-3-carboxylate Openeye Name: isopropyl 4-[3-(4-chloropyrazol-1-yl)propanoylamino]-1-ethyl-pyrazole-3-carboxylate CAS Name: 4-[[3-(4-chloro-1-pyrazolyl)-1-oxopropyl]amino]-1-ethyl-3-pyrazolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[3-(4-chloropyrazol-1-yl)propanoylamino]-1-ethylpyrazole-3-carboxylate Traditional Name: 4-[3-(4-chloropyrazol-1-yl)propanoylamino]-1-ethyl-pyrazole-3-carboxylic acid isopropyl ester Formula: C15H20ClN5O3 MolecularWeight: 353.804

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20ClN5O3/c1-4-20-9-12(14(19-20)15(23)24-10(2)3)18-13(22)5-6-21-8-11(16)7-17-21/h7-10H,4-6H2,1-3H3,(H,18,22)