2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]-N-[3-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[(5-pyrrolidinosulfonyl-2-pyridyl)thio]-N-[3-(trifluoromethyl)phenyl]acetamide Formula: C18H18F3N3O3S2 MolecularWeight: 445.47903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C18H18F3N3O3S2/c19-18(20,21)13-4-3-5-14(10-13)23-16(25)12-28-17-7-6-15(11-22-17)29(26,27)24-8-1-2-9-24/h3-7,10-11H,1-2,8-9,12H2,(H,23,25)