4,5-dimethoxy-2-nitro-N-(2-phenylsulfanylphenyl)benzamide

Systemtic Name: 4,5-dimethoxy-2-nitro-N-(2-phenylsulfanylphenyl)benzamide Openeye Name: 4,5-dimethoxy-2-nitro-N-(2-phenylsulfanylphenyl)benzamide CAS Name: 4,5-dimethoxy-2-nitro-N-[2-(phenylthio)phenyl]benzamide IUPAC Name: 4,5-dimethoxy-2-nitro-N-(2-phenylsulfanylphenyl)benzamide Traditional Name: 4,5-dimethoxy-2-nitro-N-[2-(phenylthio)phenyl]benzamide Formula: C21H18N2O5S MolecularWeight: 410.44302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)NC2=CC=CC=C2SC3=CC=CC=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)NC2=CC=CC=C2SC3=CC=CC=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C21H18N2O5S/c1-27-18-12-15(17(23(25)26)13-19(18)28-2)21(24)22-16-10-6-7-11-20(16)29-14-8-4-3-5-9-14/h3-13H,1-2H3,(H,22,24)