N-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]-2-(thiophen-2-ylmethylsulfanyl)benzamide

Systemtic Name: N-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]-2-(thiophen-2-ylmethylsulfanyl)benzamide Openeye Name: N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-2-(2-thienylmethylsulfanyl)benzamide CAS Name: N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-2-(thiophen-2-ylmethylthio)benzamide IUPAC Name: N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-2-(thiophen-2-ylmethylsulfanyl)benzamide Traditional Name: N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-2-(2-thenylthio)benzamide Formula: C20H18N2O4S2 MolecularWeight: 414.49792

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NCC(C2=CC=C(C=C2)[N+](=O)[O-])O)SCC3=CC=CS3

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NCC(C2=CC=C(C=C2)[N+](=O)[O-])O)SCC3=CC=CS3

InChI

InChI=1S/C20H18N2O4S2/c23-18(14-7-9-15(10-8-14)22(25)26)12-21-20(24)17-5-1-2-6-19(17)28-13-16-4-3-11-27-16/h1-11,18,23H,12-13H2,(H,21,24)