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

Systemtic Name: 4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)carbonylamino]butanoyl chloride Openeye Name: 4-[(3,5-dimethyl-1-phenyl-pyrazole-4-carbonyl)amino]butanoyl chloride CAS Name: 4-[[(3,5-dimethyl-1-phenyl-4-pyrazolyl)-oxomethyl]amino]butanoyl chloride IUPAC Name: 4-[(3,5-dimethyl-1-phenylpyrazole-4-carbonyl)amino]butanoyl chloride Traditional Name: 4-[(3,5-dimethyl-1-phenyl-pyrazole-4-carbonyl)amino]butyryl chloride Formula: C16H18ClN3O2 MolecularWeight: 319.78602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)NCCCC(=O)Cl

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)NCCCC(=O)Cl

InChI

InChI=1S/C16H18ClN3O2/c1-11-15(16(22)18-10-6-9-14(17)21)12(2)20(19-11)13-7-4-3-5-8-13/h3-5,7-8H,6,9-10H2,1-2H3,(H,18,22)