N'-(4-fluoranyl-3-nitro-phenyl)-N-[2-(1-thiophen-2-ylsulfonylpiperidin-2-yl)ethyl]ethanediamide

Systemtic Name: N'-(4-fluoranyl-3-nitro-phenyl)-N-[2-(1-thiophen-2-ylsulfonylpiperidin-2-yl)ethyl]ethanediamide Openeye Name: N'-(4-fluoro-3-nitro-phenyl)-N-[2-[1-(2-thienylsulfonyl)-2-piperidyl]ethyl]oxamide CAS Name: N'-(4-fluoro-3-nitrophenyl)-N-[2-(1-thiophen-2-ylsulfonyl-2-piperidinyl)ethyl]oxamide IUPAC Name: N'-(4-fluoro-3-nitrophenyl)-N-[2-(1-thiophen-2-ylsulfonylpiperidin-2-yl)ethyl]oxamide Traditional Name: N'-(4-fluoro-3-nitro-phenyl)-N-[2-[1-(2-thienylsulfonyl)-2-piperidyl]ethyl]oxamide Formula: C19H21FN4O6S2 MolecularWeight: 484.521643

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CCNC(=O)C(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-])S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1CCN(C(C1)CCNC(=O)C(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-])S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C19H21FN4O6S2/c20-15-7-6-13(12-16(15)24(27)28)22-19(26)18(25)21-9-8-14-4-1-2-10-23(14)32(29,30)17-5-3-11-31-17/h3,5-7,11-12,14H,1-2,4,8-10H2,(H,21,25)(H,22,26)