1-(5-bromanylthiophen-2-yl)sulfonyl-N-(4-phenylbutyl)piperidine-3-carboxamide

Systemtic Name: 1-(5-bromanylthiophen-2-yl)sulfonyl-N-(4-phenylbutyl)piperidine-3-carboxamide Openeye Name: 1-[(5-bromo-2-thienyl)sulfonyl]-N-(4-phenylbutyl)piperidine-3-carboxamide CAS Name: 1-[(5-bromo-2-thiophenyl)sulfonyl]-N-(4-phenylbutyl)-3-piperidinecarboxamide IUPAC Name: 1-(5-bromothiophen-2-yl)sulfonyl-N-(4-phenylbutyl)piperidine-3-carboxamide Traditional Name: 1-[(5-bromo-2-thienyl)sulfonyl]-N-(4-phenylbutyl)nipecotamide Formula: C20H25BrN2O3S2 MolecularWeight: 485.4581

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(S2)Br)C(=O)NCCCCC3=CC=CC=C3

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=C(S2)Br)C(=O)NCCCCC3=CC=CC=C3

InChI

InChI=1S/C20H25BrN2O3S2/c21-18-11-12-19(27-18)28(25,26)23-14-6-10-17(15-23)20(24)22-13-5-4-9-16-7-2-1-3-8-16/h1-3,7-8,11-12,17H,4-6,9-10,13-15H2,(H,22,24)