2-[(2-methylphenyl)methylsulfanyl]-N-(5-nitro-2-oxidanyl-phenyl)ethanamide

Systemtic Name: 2-[(2-methylphenyl)methylsulfanyl]-N-(5-nitro-2-oxidanyl-phenyl)ethanamide Openeye Name: N-(2-hydroxy-5-nitro-phenyl)-2-(o-tolylmethylsulfanyl)acetamide CAS Name: N-(2-hydroxy-5-nitrophenyl)-2-[(2-methylphenyl)methylthio]acetamide IUPAC Name: N-(2-hydroxy-5-nitrophenyl)-2-[(2-methylphenyl)methylsulfanyl]acetamide Traditional Name: N-(2-hydroxy-5-nitro-phenyl)-2-[(2-methylbenzyl)thio]acetamide Formula: C16H16N2O4S MolecularWeight: 332.37424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])O

Isomeric SMILES

CC1=CC=CC=C1CSCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])O

InChI

InChI=1S/C16H16N2O4S/c1-11-4-2-3-5-12(11)9-23-10-16(20)17-14-8-13(18(21)22)6-7-15(14)19/h2-8,19H,9-10H2,1H3,(H,17,20)