N'-(4-fluoranyl-3-nitro-phenyl)-N-[(4-thiophen-2-yloxan-4-yl)methyl]ethanediamide

Systemtic Name: N'-(4-fluoranyl-3-nitro-phenyl)-N-[(4-thiophen-2-yloxan-4-yl)methyl]ethanediamide Openeye Name: N'-(4-fluoro-3-nitro-phenyl)-N-[[4-(2-thienyl)tetrahydropyran-4-yl]methyl]oxamide CAS Name: N'-(4-fluoro-3-nitrophenyl)-N-[(4-thiophen-2-yl-4-oxanyl)methyl]oxamide IUPAC Name: N'-(4-fluoro-3-nitrophenyl)-N-[(4-thiophen-2-yloxan-4-yl)methyl]oxamide Traditional Name: N'-(4-fluoro-3-nitro-phenyl)-N-[[4-(2-thienyl)tetrahydropyran-4-yl]methyl]oxamide Formula: C18H18FN3O5S MolecularWeight: 407.416023

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(CNC(=O)C(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-])C3=CC=CS3

Isomeric SMILES

C1COCCC1(CNC(=O)C(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-])C3=CC=CS3

InChI

InChI=1S/C18H18FN3O5S/c19-13-4-3-12(10-14(13)22(25)26)21-17(24)16(23)20-11-18(5-7-27-8-6-18)15-2-1-9-28-15/h1-4,9-10H,5-8,11H2,(H,20,23)(H,21,24)