N-(3-methylsulfanylphenyl)-2-[(2-nitrophenyl)sulfonyl-phenyl-amino]ethanamide

Systemtic Name: N-(3-methylsulfanylphenyl)-2-[(2-nitrophenyl)sulfonyl-phenyl-amino]ethanamide Openeye Name: N-(3-methylsulfanylphenyl)-2-(N-(2-nitrophenyl)sulfonylanilino)acetamide CAS Name: N-[3-(methylthio)phenyl]-2-(N-(2-nitrophenyl)sulfonylanilino)acetamide IUPAC Name: N-(3-methylsulfanylphenyl)-2-(N-(2-nitrophenyl)sulfonylanilino)acetamide Traditional Name: N-[3-(methylthio)phenyl]-2-(N-(2-nitrophenyl)sulfonylanilino)acetamide Formula: C21H19N3O5S2 MolecularWeight: 457.52266

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)CN(C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)CN(C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H19N3O5S2/c1-30-18-11-7-8-16(14-18)22-21(25)15-23(17-9-3-2-4-10-17)31(28,29)20-13-6-5-12-19(20)24(26)27/h2-14H,15H2,1H3,(H,22,25)