4-[methyl-(4-methylsulfanylphenyl)sulfonyl-amino]-N-(3-nitrophenyl)benzamide

Systemtic Name: 4-[methyl-(4-methylsulfanylphenyl)sulfonyl-amino]-N-(3-nitrophenyl)benzamide Openeye Name: 4-[methyl-(4-methylsulfanylphenyl)sulfonyl-amino]-N-(3-nitrophenyl)benzamide CAS Name: 4-[methyl-[4-(methylthio)phenyl]sulfonylamino]-N-(3-nitrophenyl)benzamide IUPAC Name: 4-[methyl-(4-methylsulfanylphenyl)sulfonylamino]-N-(3-nitrophenyl)benzamide Traditional Name: 4-[methyl-[4-(methylthio)phenyl]sulfonyl-amino]-N-(3-nitrophenyl)benzamide Formula: C21H19N3O5S2 MolecularWeight: 457.52266

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CN(C1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C21H19N3O5S2/c1-23(31(28,29)20-12-10-19(30-2)11-13-20)17-8-6-15(7-9-17)21(25)22-16-4-3-5-18(14-16)24(26)27/h3-14H,1-2H3,(H,22,25)