N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-1-(3-nitrophenyl)methanesulfonamide

Systemtic Name: N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-1-(3-nitrophenyl)methanesulfonamide Openeye Name: N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-1-(3-nitrophenyl)methanesulfonamide CAS Name: N-[2-[(4-chlorophenyl)methylthio]ethyl]-1-(3-nitrophenyl)methanesulfonamide IUPAC Name: N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-1-(3-nitrophenyl)methanesulfonamide Traditional Name: N-[2-[(4-chlorobenzyl)thio]ethyl]-1-(3-nitrophenyl)methanesulfonamide Formula: C16H17ClN2O4S2 MolecularWeight: 400.90018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CS(=O)(=O)NCCSCC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CS(=O)(=O)NCCSCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H17ClN2O4S2/c17-15-6-4-13(5-7-15)11-24-9-8-18-25(22,23)12-14-2-1-3-16(10-14)19(20)21/h1-7,10,18H,8-9,11-12H2