N-[2-(phenylmethyl)phenyl]-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-(phenylmethyl)phenyl]-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-benzylphenyl)-2-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanyl]acetamide CAS Name: N-[2-(phenylmethyl)phenyl]-2-[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]acetamide IUPAC Name: N-(2-benzylphenyl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylacetamide Traditional Name: N-(2-benzylphenyl)-2-[(5-piperidinosulfonyl-2-pyridyl)thio]acetamide Formula: C25H27N3O3S2 MolecularWeight: 481.63018

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)NC3=CC=CC=C3CC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)NC3=CC=CC=C3CC4=CC=CC=C4

InChI

InChI=1S/C25H27N3O3S2/c29-24(27-23-12-6-5-11-21(23)17-20-9-3-1-4-10-20)19-32-25-14-13-22(18-26-25)33(30,31)28-15-7-2-8-16-28/h1,3-6,9-14,18H,2,7-8,15-17,19H2,(H,27,29)