8-[(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]quinoline

Systemtic Name: 8-[(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]quinoline Openeye Name: 8-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanylmethyl]quinoline CAS Name: 8-[[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]methyl]quinoline IUPAC Name: 8-[(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]quinoline Traditional Name: 8-[[(5-piperidinosulfonyl-2-pyridyl)thio]methyl]quinoline Formula: C20H21N3O2S2 MolecularWeight: 399.52964

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C20H21N3O2S2/c24-27(25,23-12-2-1-3-13-23)18-9-10-19(22-14-18)26-15-17-7-4-6-16-8-5-11-21-20(16)17/h4-11,14H,1-3,12-13,15H2