2-[(4-bromophenyl)methylsulfanyl]-5-piperidin-1-ylsulfonyl-pyridine

Systemtic Name: 2-[(4-bromophenyl)methylsulfanyl]-5-piperidin-1-ylsulfonyl-pyridine Openeye Name: 2-[(4-bromophenyl)methylsulfanyl]-5-(1-piperidylsulfonyl)pyridine CAS Name: 2-[(4-bromophenyl)methylthio]-5-(1-piperidinylsulfonyl)pyridine IUPAC Name: 2-[(4-bromophenyl)methylsulfanyl]-5-piperidin-1-ylsulfonylpyridine Traditional Name: 2-[(4-bromobenzyl)thio]-5-piperidinosulfonyl-pyridine Formula: C17H19BrN2O2S2 MolecularWeight: 427.37896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC3=CC=C(C=C3)Br

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC3=CC=C(C=C3)Br

InChI

InChI=1S/C17H19BrN2O2S2/c18-15-6-4-14(5-7-15)13-23-17-9-8-16(12-19-17)24(21,22)20-10-2-1-3-11-20/h4-9,12H,1-3,10-11,13H2