(3S)-1-(4-bromophenyl)sulfonyl-N-(6-methylpyridin-2-yl)piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-bromophenyl)sulfonyl-N-(6-methylpyridin-2-yl)piperidine-3-carboxamide Openeye Name: (3S)-1-(4-bromophenyl)sulfonyl-N-(6-methyl-2-pyridyl)piperidine-3-carboxamide CAS Name: (3S)-1-(4-bromophenyl)sulfonyl-N-(6-methyl-2-pyridinyl)-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-bromophenyl)sulfonyl-N-(6-methylpyridin-2-yl)piperidine-3-carboxamide Traditional Name: (3S)-1-brosyl-N-(6-methyl-2-pyridyl)nipecotamide Formula: C18H20BrN3O3S MolecularWeight: 438.3387

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=NC(=CC=C1)NC(=O)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H20BrN3O3S/c1-13-4-2-6-17(20-13)21-18(23)14-5-3-11-22(12-14)26(24,25)16-9-7-15(19)8-10-16/h2,4,6-10,14H,3,5,11-12H2,1H3,(H,20,21,23)/t14-/m0/s1