N-[(2-bromophenyl)methyl]-N-methyl-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(2-bromophenyl)methyl]-N-methyl-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-[(2-bromophenyl)methyl]-N-methyl-2-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanyl]acetamide CAS Name: N-[(2-bromophenyl)methyl]-N-methyl-2-[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]acetamide IUPAC Name: N-[(2-bromophenyl)methyl]-N-methyl-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylacetamide Traditional Name: N-(2-bromobenzyl)-N-methyl-2-[(5-piperidinosulfonyl-2-pyridyl)thio]acetamide Formula: C20H24BrN3O3S2 MolecularWeight: 498.45686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1Br)C(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CN(CC1=CC=CC=C1Br)C(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H24BrN3O3S2/c1-23(14-16-7-3-4-8-18(16)21)20(25)15-28-19-10-9-17(13-22-19)29(26,27)24-11-5-2-6-12-24/h3-4,7-10,13H,2,5-6,11-12,14-15H2,1H3