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

Systemtic Name: ethyl 5-[2-(4-bromanyl-3-methyl-pyrazol-1-yl)propanoylamino]-1-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[2-(4-bromo-3-methyl-pyrazol-1-yl)propanoylamino]-1-methyl-pyrazole-4-carboxylate CAS Name: 5-[[2-(4-bromo-3-methyl-1-pyrazolyl)-1-oxopropyl]amino]-1-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-(4-bromo-3-methylpyrazol-1-yl)propanoylamino]-1-methylpyrazole-4-carboxylate Traditional Name: 5-[2-(4-bromo-3-methyl-pyrazol-1-yl)propanoylamino]-1-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C14H18BrN5O3 MolecularWeight: 384.22842

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C)NC(=O)C(C)N2C=C(C(=N2)C)Br

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C)NC(=O)C(C)N2C=C(C(=N2)C)Br

InChI

InChI=1S/C14H18BrN5O3/c1-5-23-14(22)10-6-16-19(4)12(10)17-13(21)9(3)20-7-11(15)8(2)18-20/h6-7,9H,5H2,1-4H3,(H,17,21)