N-[2-[(3,4-dichlorophenyl)methylsulfanyl]ethyl]-4-nitro-benzamide

Systemtic Name: N-[2-[(3,4-dichlorophenyl)methylsulfanyl]ethyl]-4-nitro-benzamide Openeye Name: N-[2-[(3,4-dichlorophenyl)methylsulfanyl]ethyl]-4-nitro-benzamide CAS Name: N-[2-[(3,4-dichlorophenyl)methylthio]ethyl]-4-nitrobenzamide IUPAC Name: N-[2-[(3,4-dichlorophenyl)methylsulfanyl]ethyl]-4-nitrobenzamide Traditional Name: N-[2-[(3,4-dichlorobenzyl)thio]ethyl]-4-nitro-benzamide Formula: C16H14Cl2N2O3S MolecularWeight: 385.26496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCCSCC2=CC(=C(C=C2)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCCSCC2=CC(=C(C=C2)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H14Cl2N2O3S/c17-14-6-1-11(9-15(14)18)10-24-8-7-19-16(21)12-2-4-13(5-3-12)20(22)23/h1-6,9H,7-8,10H2,(H,19,21)