N'-[4-(4-chloranyl-2-methyl-phenoxy)butanoyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carbohydrazide

Systemtic Name: N'-[4-(4-chloranyl-2-methyl-phenoxy)butanoyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carbohydrazide Openeye Name: N'-[4-(4-chloro-2-methyl-phenoxy)butanoyl]-1-(3-pyridylsulfonyl)piperidine-4-carbohydrazide CAS Name: N'-[4-(4-chloro-2-methylphenoxy)-1-oxobutyl]-1-(3-pyridinylsulfonyl)-4-piperidinecarbohydrazide IUPAC Name: N'-[4-(4-chloro-2-methylphenoxy)butanoyl]-1-pyridin-3-ylsulfonylpiperidine-4-carbohydrazide Traditional Name: N'-[4-(4-chloro-2-methyl-phenoxy)butanoyl]-1-(3-pyridylsulfonyl)isonipecotohydrazide Formula: C22H27ClN4O5S MolecularWeight: 494.99158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NNC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NNC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C22H27ClN4O5S/c1-16-14-18(23)6-7-20(16)32-13-3-5-21(28)25-26-22(29)17-8-11-27(12-9-17)33(30,31)19-4-2-10-24-15-19/h2,4,6-7,10,14-15,17H,3,5,8-9,11-13H2,1H3,(H,25,28)(H,26,29)