2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanyl-N-(2-phenylbutyl)ethanamide

Systemtic Name: 2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanyl-N-(2-phenylbutyl)ethanamide Openeye Name: 2-[(5-morpholinosulfonyl-2-pyridyl)sulfanyl]-N-(2-phenylbutyl)acetamide CAS Name: 2-[[5-(4-morpholinylsulfonyl)-2-pyridinyl]thio]-N-(2-phenylbutyl)acetamide IUPAC Name: 2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanyl-N-(2-phenylbutyl)acetamide Traditional Name: 2-[(5-morpholinosulfonyl-2-pyridyl)thio]-N-(2-phenylbutyl)acetamide Formula: C21H27N3O4S2 MolecularWeight: 449.58678

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)CSC1=NC=C(C=C1)S(=O)(=O)N2CCOCC2)C3=CC=CC=C3

Isomeric SMILES

CCC(CNC(=O)CSC1=NC=C(C=C1)S(=O)(=O)N2CCOCC2)C3=CC=CC=C3

InChI

InChI=1S/C21H27N3O4S2/c1-2-17(18-6-4-3-5-7-18)14-22-20(25)16-29-21-9-8-19(15-23-21)30(26,27)24-10-12-28-13-11-24/h3-9,15,17H,2,10-14,16H2,1H3,(H,22,25)