2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N'-[2-(2-oxidanylideneazepan-1-yl)ethanoyl]ethanehydrazide

Systemtic Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N'-[2-(2-oxidanylideneazepan-1-yl)ethanoyl]ethanehydrazide Openeye Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N'-[2-(2-oxoazepan-1-yl)acetyl]acetohydrazide CAS Name: 2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-N'-[1-oxo-2-(2-oxo-1-azepanyl)ethyl]acetohydrazide IUPAC Name: 2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-N'-[2-(2-oxoazepan-1-yl)acetyl]acetohydrazide Traditional Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N'-[2-(2-ketoazepan-1-yl)acetyl]acetohydrazide Formula: C21H27N5O3 MolecularWeight: 397.47078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CC(=O)NNC(=O)CN3CCCCCC3=O

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CC(=O)NNC(=O)CN3CCCCCC3=O

InChI

InChI=1S/C21H27N5O3/c1-15-18(16(2)26(24-15)17-9-5-3-6-10-17)13-19(27)22-23-20(28)14-25-12-8-4-7-11-21(25)29/h3,5-6,9-10H,4,7-8,11-14H2,1-2H3,(H,22,27)(H,23,28)