dimethyl 3-[4-[(4-bromanyl-2-ethyl-5-methyl-pyrazol-3-yl)carbonylamino]pyrazol-1-yl]pentanedioate

Systemtic Name: dimethyl 3-[4-[(4-bromanyl-2-ethyl-5-methyl-pyrazol-3-yl)carbonylamino]pyrazol-1-yl]pentanedioate Openeye Name: dimethyl 3-[4-[(4-bromo-2-ethyl-5-methyl-pyrazole-3-carbonyl)amino]pyrazol-1-yl]pentanedioate CAS Name: 3-[4-[[(4-bromo-2-ethyl-5-methyl-3-pyrazolyl)-oxomethyl]amino]-1-pyrazolyl]pentanedioic acid dimethyl ester IUPAC Name: dimethyl 3-[4-[(4-bromo-2-ethyl-5-methylpyrazole-3-carbonyl)amino]pyrazol-1-yl]pentanedioate Traditional Name: 3-[4-[(4-bromo-2-ethyl-5-methyl-pyrazole-3-carbonyl)amino]pyrazol-1-yl]glutaric acid dimethyl ester Formula: C17H22BrN5O5 MolecularWeight: 456.29108

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)Br)C(=O)NC2=CN(N=C2)C(CC(=O)OC)CC(=O)OC

Isomeric SMILES

CCN1C(=C(C(=N1)C)Br)C(=O)NC2=CN(N=C2)C(CC(=O)OC)CC(=O)OC

InChI

InChI=1S/C17H22BrN5O5/c1-5-22-16(15(18)10(2)21-22)17(26)20-11-8-19-23(9-11)12(6-13(24)27-3)7-14(25)28-4/h8-9,12H,5-7H2,1-4H3,(H,20,26)