N'-[(3-chloranyl-6-fluoranyl-1-benzothiophen-2-yl)carbonyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carbohydrazide

Systemtic Name: N'-[(3-chloranyl-6-fluoranyl-1-benzothiophen-2-yl)carbonyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carbohydrazide Openeye Name: N'-(3-chloro-6-fluoro-benzothiophene-2-carbonyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carbohydrazide CAS Name: N'-[(3-chloro-6-fluoro-1-benzothiophen-2-yl)-oxomethyl]-1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinecarbohydrazide IUPAC Name: N'-(3-chloro-6-fluoro-1-benzothiophene-2-carbonyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carbohydrazide Traditional Name: N'-(3-chloro-6-fluoro-benzothiophene-2-carbonyl)-1-[(E)-3-phenylacryloyl]isonipecotohydrazide Formula: C24H21ClFN3O3S MolecularWeight: 485.958243

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NNC(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NNC(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C24H21ClFN3O3S/c25-21-18-8-7-17(26)14-19(18)33-22(21)24(32)28-27-23(31)16-10-12-29(13-11-16)20(30)9-6-15-4-2-1-3-5-15/h1-9,14,16H,10-13H2,(H,27,31)(H,28,32)/b9-6+