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

Systemtic Name: propan-2-yl 4-[2-(4-bromanylpyrazol-1-yl)propanoylamino]-1-ethyl-pyrazole-3-carboxylate Openeye Name: isopropyl 4-[2-(4-bromopyrazol-1-yl)propanoylamino]-1-ethyl-pyrazole-3-carboxylate CAS Name: 4-[[2-(4-bromo-1-pyrazolyl)-1-oxopropyl]amino]-1-ethyl-3-pyrazolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[2-(4-bromopyrazol-1-yl)propanoylamino]-1-ethylpyrazole-3-carboxylate Traditional Name: 4-[2-(4-bromopyrazol-1-yl)propanoylamino]-1-ethyl-pyrazole-3-carboxylic acid isopropyl ester Formula: C15H20BrN5O3 MolecularWeight: 398.255

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)OC(C)C)NC(=O)C(C)N2C=C(C=N2)Br

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)OC(C)C)NC(=O)C(C)N2C=C(C=N2)Br

InChI

InChI=1S/C15H20BrN5O3/c1-5-20-8-12(13(19-20)15(23)24-9(2)3)18-14(22)10(4)21-7-11(16)6-17-21/h6-10H,5H2,1-4H3,(H,18,22)