1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-N-[(E)-1-thiophen-2-ylethylideneamino]piperidine-4-carboxamide

Systemtic Name: 1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-N-[(E)-1-thiophen-2-ylethylideneamino]piperidine-4-carboxamide Openeye Name: 1-[(2-chloro-4-fluoro-phenyl)methyl]-N-[(E)-1-(2-thienyl)ethylideneamino]piperidine-4-carboxamide CAS Name: 1-[(2-chloro-4-fluorophenyl)methyl]-N-[(E)-1-thiophen-2-ylethylideneamino]-4-piperidinecarboxamide IUPAC Name: 1-[(2-chloro-4-fluorophenyl)methyl]-N-[(E)-1-thiophen-2-ylethylideneamino]piperidine-4-carboxamide Traditional Name: 1-(2-chloro-4-fluoro-benzyl)-N-[(E)-1-(2-thienyl)ethylideneamino]isonipecotamide Formula: C19H21ClFN3OS MolecularWeight: 393.905943

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1CCN(CC1)CC2=C(C=C(C=C2)F)Cl)C3=CC=CS3

Isomeric SMILES

C/C(=N\NC(=O)C1CCN(CC1)CC2=C(C=C(C=C2)F)Cl)/C3=CC=CS3

InChI

InChI=1S/C19H21ClFN3OS/c1-13(18-3-2-10-26-18)22-23-19(25)14-6-8-24(9-7-14)12-15-4-5-16(21)11-17(15)20/h2-5,10-11,14H,6-9,12H2,1H3,(H,23,25)/b22-13+