4-[[1-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]pyrazol-3-yl]carbonylamino]butanoyl chloride

Systemtic Name: 4-[[1-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]pyrazol-3-yl]carbonylamino]butanoyl chloride Openeye Name: 4-[[1-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]pyrazole-3-carbonyl]amino]butanoyl chloride CAS Name: 4-[[[1-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-3-pyrazolyl]-oxomethyl]amino]butanoyl chloride IUPAC Name: 4-[[1-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]pyrazole-3-carbonyl]amino]butanoyl chloride Traditional Name: 4-[[1-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]pyrazole-3-carbonyl]amino]butyryl chloride Formula: C14H17BrClN5O2 MolecularWeight: 402.67408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CN2C=CC(=N2)C(=O)NCCCC(=O)Cl)C)Br

Isomeric SMILES

CC1=C(C(=NN1CN2C=CC(=N2)C(=O)NCCCC(=O)Cl)C)Br

InChI

InChI=1S/C14H17BrClN5O2/c1-9-13(15)10(2)21(18-9)8-20-7-5-11(19-20)14(23)17-6-3-4-12(16)22/h5,7H,3-4,6,8H2,1-2H3,(H,17,23)