2-[(3-bromophenyl)methylsulfanyl]-5-piperidin-1-ylsulfonyl-pyridine

Systemtic Name: 2-[(3-bromophenyl)methylsulfanyl]-5-piperidin-1-ylsulfonyl-pyridine Openeye Name: 2-[(3-bromophenyl)methylsulfanyl]-5-(1-piperidylsulfonyl)pyridine CAS Name: 2-[(3-bromophenyl)methylthio]-5-(1-piperidinylsulfonyl)pyridine IUPAC Name: 2-[(3-bromophenyl)methylsulfanyl]-5-piperidin-1-ylsulfonylpyridine Traditional Name: 2-[(3-bromobenzyl)thio]-5-piperidinosulfonyl-pyridine Formula: C17H19BrN2O2S2 MolecularWeight: 427.37896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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