N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-ethyl]-N'-(4-nitrophenyl)ethanediamide

Systemtic Name: N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-ethyl]-N'-(4-nitrophenyl)ethanediamide Openeye Name: N'-(4-nitrophenyl)-N-[2-(p-tolylsulfonyl)-2-(2-thienyl)ethyl]oxamide CAS Name: N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-ylethyl]-N'-(4-nitrophenyl)oxamide IUPAC Name: N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-ylethyl]-N'-(4-nitrophenyl)oxamide Traditional Name: N'-(4-nitrophenyl)-N-[2-(2-thienyl)-2-tosyl-ethyl]oxamide Formula: C21H19N3O6S2 MolecularWeight: 473.52206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CS3

InChI

InChI=1S/C21H19N3O6S2/c1-14-4-10-17(11-5-14)32(29,30)19(18-3-2-12-31-18)13-22-20(25)21(26)23-15-6-8-16(9-7-15)24(27)28/h2-12,19H,13H2,1H3,(H,22,25)(H,23,26)