N-[2-[(5-bromanylthiophen-2-yl)methylsulfanyl]ethyl]-1-methylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-[(5-bromanylthiophen-2-yl)methylsulfanyl]ethyl]-1-methylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-[(5-bromo-2-thienyl)methylsulfanyl]ethyl]-1-methylsulfonyl-piperidine-4-carboxamide CAS Name: N-[2-[(5-bromo-2-thiophenyl)methylthio]ethyl]-1-methylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-[(5-bromothiophen-2-yl)methylsulfanyl]ethyl]-1-methylsulfonylpiperidine-4-carboxamide Traditional Name: N-[2-[(5-bromo-2-thienyl)methylthio]ethyl]-1-mesyl-isonipecotamide Formula: C14H21BrN2O3S3 MolecularWeight: 441.42714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)C(=O)NCCSCC2=CC=C(S2)Br

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)C(=O)NCCSCC2=CC=C(S2)Br

InChI

InChI=1S/C14H21BrN2O3S3/c1-23(19,20)17-7-4-11(5-8-17)14(18)16-6-9-21-10-12-2-3-13(15)22-12/h2-3,11H,4-10H2,1H3,(H,16,18)