N-(2-ethylsulfanylphenyl)-2-[(3-nitrophenyl)-(phenylsulfonyl)amino]ethanamide

Systemtic Name: N-(2-ethylsulfanylphenyl)-2-[(3-nitrophenyl)-(phenylsulfonyl)amino]ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-3-nitro-anilino]-N-(2-ethylsulfanylphenyl)acetamide CAS Name: 2-[N-(benzenesulfonyl)-3-nitroanilino]-N-[2-(ethylthio)phenyl]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-3-nitroanilino]-N-(2-ethylsulfanylphenyl)acetamide Traditional Name: 2-(N-besyl-3-nitro-anilino)-N-[2-(ethylthio)phenyl]acetamide Formula: C22H21N3O5S2 MolecularWeight: 471.54924

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1NC(=O)CN(C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCSC1=CC=CC=C1NC(=O)CN(C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H21N3O5S2/c1-2-31-21-14-7-6-13-20(21)23-22(26)16-24(17-9-8-10-18(15-17)25(27)28)32(29,30)19-11-4-3-5-12-19/h3-15H,2,16H2,1H3,(H,23,26)