N-[2-(4-methylphenyl)sulfanylethyl]-2-[(2-nitrophenyl)sulfonyl-phenyl-amino]ethanamide

Systemtic Name: N-[2-(4-methylphenyl)sulfanylethyl]-2-[(2-nitrophenyl)sulfonyl-phenyl-amino]ethanamide Openeye Name: 2-(N-(2-nitrophenyl)sulfonylanilino)-N-[2-(p-tolylsulfanyl)ethyl]acetamide CAS Name: N-[2-[(4-methylphenyl)thio]ethyl]-2-(N-(2-nitrophenyl)sulfonylanilino)acetamide IUPAC Name: N-[2-(4-methylphenyl)sulfanylethyl]-2-(N-(2-nitrophenyl)sulfonylanilino)acetamide Traditional Name: 2-(N-(2-nitrophenyl)sulfonylanilino)-N-[2-(p-tolylthio)ethyl]acetamide Formula: C23H23N3O5S2 MolecularWeight: 485.57582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)CN(C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)CN(C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C23H23N3O5S2/c1-18-11-13-20(14-12-18)32-16-15-24-23(27)17-25(19-7-3-2-4-8-19)33(30,31)22-10-6-5-9-21(22)26(28)29/h2-14H,15-17H2,1H3,(H,24,27)