N-[2-(1H-indol-3-yl)ethyl]-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-(1H-indol-3-yl)ethyl]-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-[2-(1H-indol-3-yl)ethyl]-2-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanyl]acetamide CAS Name: N-[2-(1H-indol-3-yl)ethyl]-2-[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]acetamide IUPAC Name: N-[2-(1H-indol-3-yl)ethyl]-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylacetamide Traditional Name: N-[2-(1H-indol-3-yl)ethyl]-2-[(5-piperidinosulfonyl-2-pyridyl)thio]acetamide Formula: C22H26N4O3S2 MolecularWeight: 458.59684

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)NCCC3=CNC4=CC=CC=C43

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)NCCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C22H26N4O3S2/c27-21(23-11-10-17-14-24-20-7-3-2-6-19(17)20)16-30-22-9-8-18(15-25-22)31(28,29)26-12-4-1-5-13-26/h2-3,6-9,14-15,24H,1,4-5,10-13,16H2,(H,23,27)