1-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfonyl]-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfonyl]-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-[(2-chloro-6-fluoro-phenyl)methylsulfonyl]-N-(4-pyridylmethyl)piperidine-4-carboxamide CAS Name: 1-[(2-chloro-6-fluorophenyl)methylsulfonyl]-N-(pyridin-4-ylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-[(2-chloro-6-fluorophenyl)methylsulfonyl]-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-(2-chloro-6-fluoro-benzyl)sulfonyl-N-(4-pyridylmethyl)isonipecotamide Formula: C19H21ClFN3O3S MolecularWeight: 425.904743

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC=NC=C2)S(=O)(=O)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC=NC=C2)S(=O)(=O)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C19H21ClFN3O3S/c20-17-2-1-3-18(21)16(17)13-28(26,27)24-10-6-15(7-11-24)19(25)23-12-14-4-8-22-9-5-14/h1-5,8-9,15H,6-7,10-13H2,(H,23,25)