1-(5-bromanylthiophen-2-yl)sulfonyl-N-(4-methyl-2-oxidanyl-phenyl)piperidine-3-carboxamide

Systemtic Name: 1-(5-bromanylthiophen-2-yl)sulfonyl-N-(4-methyl-2-oxidanyl-phenyl)piperidine-3-carboxamide Openeye Name: 1-[(5-bromo-2-thienyl)sulfonyl]-N-(2-hydroxy-4-methyl-phenyl)piperidine-3-carboxamide CAS Name: 1-[(5-bromo-2-thiophenyl)sulfonyl]-N-(2-hydroxy-4-methylphenyl)-3-piperidinecarboxamide IUPAC Name: 1-(5-bromothiophen-2-yl)sulfonyl-N-(2-hydroxy-4-methylphenyl)piperidine-3-carboxamide Traditional Name: 1-[(5-bromo-2-thienyl)sulfonyl]-N-(2-hydroxy-4-methyl-phenyl)nipecotamide Formula: C17H19BrN2O4S2 MolecularWeight: 459.37776

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19BrN2O4S2/c1-11-4-5-13(14(21)9-11)19-17(22)12-3-2-8-20(10-12)26(23,24)16-7-6-15(18)25-16/h4-7,9,12,21H,2-3,8,10H2,1H3,(H,19,22)