2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-N-(2-propoxyphenyl)ethanamide

Systemtic Name: 2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-N-(2-propoxyphenyl)ethanamide Openeye Name: 2-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanyl]-N-(2-propoxyphenyl)acetamide CAS Name: 2-[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]-N-(2-propoxyphenyl)acetamide IUPAC Name: 2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-N-(2-propoxyphenyl)acetamide Traditional Name: 2-[(5-piperidinosulfonyl-2-pyridyl)thio]-N-(2-propoxyphenyl)acetamide Formula: C21H27N3O4S2 MolecularWeight: 449.58678

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1NC(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCCOC1=CC=CC=C1NC(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H27N3O4S2/c1-2-14-28-19-9-5-4-8-18(19)23-20(25)16-29-21-11-10-17(15-22-21)30(26,27)24-12-6-3-7-13-24/h4-5,8-11,15H,2-3,6-7,12-14,16H2,1H3,(H,23,25)