N-[2-(4-fluorophenyl)ethyl]-N'-(2-pyridin-3-yl-2-thiophen-2-ylsulfonyl-ethyl)ethanediamide

Systemtic Name: N-[2-(4-fluorophenyl)ethyl]-N'-(2-pyridin-3-yl-2-thiophen-2-ylsulfonyl-ethyl)ethanediamide Openeye Name: N-[2-(4-fluorophenyl)ethyl]-N'-[2-(3-pyridyl)-2-(2-thienylsulfonyl)ethyl]oxamide CAS Name: N-[2-(4-fluorophenyl)ethyl]-N'-[2-(3-pyridinyl)-2-thiophen-2-ylsulfonylethyl]oxamide IUPAC Name: N-[2-(4-fluorophenyl)ethyl]-N'-(2-pyridin-3-yl-2-thiophen-2-ylsulfonylethyl)oxamide Traditional Name: N-[2-(4-fluorophenyl)ethyl]-N'-[2-(3-pyridyl)-2-(2-thienylsulfonyl)ethyl]oxamide Formula: C21H20FN3O4S2 MolecularWeight: 461.529603

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(CNC(=O)C(=O)NCCC2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1=CC(=CN=C1)C(CNC(=O)C(=O)NCCC2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C21H20FN3O4S2/c22-17-7-5-15(6-8-17)9-11-24-20(26)21(27)25-14-18(16-3-1-10-23-13-16)31(28,29)19-4-2-12-30-19/h1-8,10,12-13,18H,9,11,14H2,(H,24,26)(H,25,27)