2-[(4-methoxy-3-nitro-phenyl)sulfonyl-methyl-amino]-N-(2-methylsulfanylphenyl)ethanamide

Systemtic Name: 2-[(4-methoxy-3-nitro-phenyl)sulfonyl-methyl-amino]-N-(2-methylsulfanylphenyl)ethanamide Openeye Name: 2-[(4-methoxy-3-nitro-phenyl)sulfonyl-methyl-amino]-N-(2-methylsulfanylphenyl)acetamide CAS Name: 2-[(4-methoxy-3-nitrophenyl)sulfonyl-methylamino]-N-[2-(methylthio)phenyl]acetamide IUPAC Name: 2-[(4-methoxy-3-nitrophenyl)sulfonyl-methylamino]-N-(2-methylsulfanylphenyl)acetamide Traditional Name: 2-[(4-methoxy-3-nitro-phenyl)sulfonyl-methyl-amino]-N-[2-(methylthio)phenyl]acetamide Formula: C17H19N3O6S2 MolecularWeight: 425.47926

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=CC=C1SC)S(=O)(=O)C2=CC(=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CN(CC(=O)NC1=CC=CC=C1SC)S(=O)(=O)C2=CC(=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O6S2/c1-19(11-17(21)18-13-6-4-5-7-16(13)27-3)28(24,25)12-8-9-15(26-2)14(10-12)20(22)23/h4-10H,11H2,1-3H3,(H,18,21)