2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-1-(1H-pyrrol-2-yl)ethanone

Systemtic Name: 2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-1-(1H-pyrrol-2-yl)ethanone Openeye Name: 2-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanyl]-1-(1H-pyrrol-2-yl)ethanone CAS Name: 2-[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]-1-(1H-pyrrol-2-yl)ethanone IUPAC Name: 2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-1-(1H-pyrrol-2-yl)ethanone Traditional Name: 2-[(5-piperidinosulfonyl-2-pyridyl)thio]-1-(1H-pyrrol-2-yl)ethanone Formula: C16H19N3O3S2 MolecularWeight: 365.47036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)C3=CC=CN3

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)C3=CC=CN3

InChI

InChI=1S/C16H19N3O3S2/c20-15(14-5-4-8-17-14)12-23-16-7-6-13(11-18-16)24(21,22)19-9-2-1-3-10-19/h4-8,11,17H,1-3,9-10,12H2