N'-[2-(2-oxidanylideneazepan-1-yl)ethanoyl]-1-(phenylmethyl)pyrazole-4-carbohydrazide

Systemtic Name: N'-[2-(2-oxidanylideneazepan-1-yl)ethanoyl]-1-(phenylmethyl)pyrazole-4-carbohydrazide Openeye Name: 1-benzyl-N'-[2-(2-oxoazepan-1-yl)acetyl]pyrazole-4-carbohydrazide CAS Name: N'-[1-oxo-2-(2-oxo-1-azepanyl)ethyl]-1-(phenylmethyl)-4-pyrazolecarbohydrazide IUPAC Name: 1-benzyl-N'-[2-(2-oxoazepan-1-yl)acetyl]pyrazole-4-carbohydrazide Traditional Name: 1-benzyl-N'-[2-(2-ketoazepan-1-yl)acetyl]pyrazole-4-carbohydrazide Formula: C19H23N5O3 MolecularWeight: 369.41762

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CC(=O)NNC(=O)C2=CN(N=C2)CC3=CC=CC=C3

Isomeric SMILES

C1CCC(=O)N(CC1)CC(=O)NNC(=O)C2=CN(N=C2)CC3=CC=CC=C3

InChI

InChI=1S/C19H23N5O3/c25-17(14-23-10-6-2-5-9-18(23)26)21-22-19(27)16-11-20-24(13-16)12-15-7-3-1-4-8-15/h1,3-4,7-8,11,13H,2,5-6,9-10,12,14H2,(H,21,25)(H,22,27)