methyl 4-[2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propanoylamino]-1-ethyl-pyrazole-3-carboxylate

Systemtic Name: methyl 4-[2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propanoylamino]-1-ethyl-pyrazole-3-carboxylate Openeye Name: methyl 4-[2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propanoylamino]-1-ethyl-pyrazole-3-carboxylate CAS Name: 4-[[2-(4-bromo-3,5-dimethyl-1-pyrazolyl)-1-oxopropyl]amino]-1-ethyl-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)propanoylamino]-1-ethylpyrazole-3-carboxylate Traditional Name: 4-[2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propanoylamino]-1-ethyl-pyrazole-3-carboxylic acid methyl ester Formula: C15H20BrN5O3 MolecularWeight: 398.255

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20BrN5O3/c1-6-20-7-11(13(19-20)15(23)24-5)17-14(22)10(4)21-9(3)12(16)8(2)18-21/h7,10H,6H2,1-5H3,(H,17,22)