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

Systemtic Name: ethyl 5-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propylcarbamoyl]-2-methyl-pyrazole-3-carboxylate Openeye Name: ethyl 5-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propylcarbamoyl]-2-methyl-pyrazole-3-carboxylate CAS Name: 5-[[3-(4-bromo-3,5-dimethyl-1-pyrazolyl)propylamino]-oxomethyl]-2-methyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)propylcarbamoyl]-2-methylpyrazole-3-carboxylate Traditional Name: 5-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propylcarbamoyl]-2-methyl-pyrazole-3-carboxylic acid ethyl ester Formula: C16H22BrN5O3 MolecularWeight: 412.28158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NN1C)C(=O)NCCCN2C(=C(C(=N2)C)Br)C

Isomeric SMILES

CCOC(=O)C1=CC(=NN1C)C(=O)NCCCN2C(=C(C(=N2)C)Br)C

InChI

InChI=1S/C16H22BrN5O3/c1-5-25-16(24)13-9-12(20-21(13)4)15(23)18-7-6-8-22-11(3)14(17)10(2)19-22/h9H,5-8H2,1-4H3,(H,18,23)