N-[2-(3-bromanylphenoxy)ethyl]-1-(5-methylthiophen-2-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[2-(3-bromanylphenoxy)ethyl]-1-(5-methylthiophen-2-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[2-(3-bromophenoxy)ethyl]-1-[(5-methyl-2-thienyl)sulfonyl]piperidine-3-carboxamide CAS Name: N-[2-(3-bromophenoxy)ethyl]-1-[(5-methyl-2-thiophenyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-[2-(3-bromophenoxy)ethyl]-1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-[2-(3-bromophenoxy)ethyl]-1-[(5-methyl-2-thienyl)sulfonyl]nipecotamide Formula: C19H23BrN2O4S2 MolecularWeight: 487.43092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NCCOC3=CC(=CC=C3)Br

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NCCOC3=CC(=CC=C3)Br

InChI

InChI=1S/C19H23BrN2O4S2/c1-14-7-8-18(27-14)28(24,25)22-10-3-4-15(13-22)19(23)21-9-11-26-17-6-2-5-16(20)12-17/h2,5-8,12,15H,3-4,9-11,13H2,1H3,(H,21,23)