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

Systemtic Name: propan-2-yl 4-[3-(4-bromanyl-5-methyl-pyrazol-1-yl)propanoylamino]-1-ethyl-pyrazole-3-carboxylate Openeye Name: isopropyl 4-[3-(4-bromo-5-methyl-pyrazol-1-yl)propanoylamino]-1-ethyl-pyrazole-3-carboxylate CAS Name: 4-[[3-(4-bromo-5-methyl-1-pyrazolyl)-1-oxopropyl]amino]-1-ethyl-3-pyrazolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[3-(4-bromo-5-methylpyrazol-1-yl)propanoylamino]-1-ethylpyrazole-3-carboxylate Traditional Name: 4-[3-(4-bromo-5-methyl-pyrazol-1-yl)propanoylamino]-1-ethyl-pyrazole-3-carboxylic acid isopropyl ester Formula: C16H22BrN5O3 MolecularWeight: 412.28158

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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)Br)C

Isomeric SMILES

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

InChI

InChI=1S/C16H22BrN5O3/c1-5-21-9-13(15(20-21)16(24)25-10(2)3)19-14(23)6-7-22-11(4)12(17)8-18-22/h8-10H,5-7H2,1-4H3,(H,19,23)