(3S)-1-(5-bromanylthiophen-2-yl)sulfonyl-N-(5-chloranyl-2-methyl-phenyl)piperidine-3-carboxamide

Systemtic Name: (3S)-1-(5-bromanylthiophen-2-yl)sulfonyl-N-(5-chloranyl-2-methyl-phenyl)piperidine-3-carboxamide Openeye Name: (3S)-1-[(5-bromo-2-thienyl)sulfonyl]-N-(5-chloro-2-methyl-phenyl)piperidine-3-carboxamide CAS Name: (3S)-1-[(5-bromo-2-thiophenyl)sulfonyl]-N-(5-chloro-2-methylphenyl)-3-piperidinecarboxamide IUPAC Name: (3S)-1-(5-bromothiophen-2-yl)sulfonyl-N-(5-chloro-2-methylphenyl)piperidine-3-carboxamide Traditional Name: (3S)-1-[(5-bromo-2-thienyl)sulfonyl]-N-(5-chloro-2-methyl-phenyl)nipecotamide Formula: C17H18BrClN2O3S2 MolecularWeight: 477.82342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=O)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C17H18BrClN2O3S2/c1-11-4-5-13(19)9-14(11)20-17(22)12-3-2-8-21(10-12)26(23,24)16-7-6-15(18)25-16/h4-7,9,12H,2-3,8,10H2,1H3,(H,20,22)/t12-/m0/s1