1-(4-bromophenyl)sulfonyl-N-(pyridin-4-ylmethyl)piperidine-3-carboxamide

Systemtic Name: 1-(4-bromophenyl)sulfonyl-N-(pyridin-4-ylmethyl)piperidine-3-carboxamide Openeye Name: 1-(4-bromophenyl)sulfonyl-N-(4-pyridylmethyl)piperidine-3-carboxamide CAS Name: 1-(4-bromophenyl)sulfonyl-N-(pyridin-4-ylmethyl)-3-piperidinecarboxamide IUPAC Name: 1-(4-bromophenyl)sulfonyl-N-(pyridin-4-ylmethyl)piperidine-3-carboxamide Traditional Name: 1-brosyl-N-(4-pyridylmethyl)nipecotamide Formula: C18H20BrN3O3S MolecularWeight: 438.3387

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)Br)C(=O)NCC3=CC=NC=C3

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)Br)C(=O)NCC3=CC=NC=C3

InChI

InChI=1S/C18H20BrN3O3S/c19-16-3-5-17(6-4-16)26(24,25)22-11-1-2-15(13-22)18(23)21-12-14-7-9-20-10-8-14/h3-10,15H,1-2,11-13H2,(H,21,23)