N-(2-chloranyl-4,5-dimethoxy-phenyl)-2-(2-fluorophenyl)sulfanyl-5-nitro-benzamide

Systemtic Name: N-(2-chloranyl-4,5-dimethoxy-phenyl)-2-(2-fluorophenyl)sulfanyl-5-nitro-benzamide Openeye Name: N-(2-chloro-4,5-dimethoxy-phenyl)-2-(2-fluorophenyl)sulfanyl-5-nitro-benzamide CAS Name: N-(2-chloro-4,5-dimethoxyphenyl)-2-[(2-fluorophenyl)thio]-5-nitrobenzamide IUPAC Name: N-(2-chloro-4,5-dimethoxyphenyl)-2-(2-fluorophenyl)sulfanyl-5-nitrobenzamide Traditional Name: N-(2-chloro-4,5-dimethoxy-phenyl)-2-[(2-fluorophenyl)thio]-5-nitro-benzamide Formula: C21H16ClFN2O5S MolecularWeight: 462.878543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])SC3=CC=CC=C3F)Cl)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])SC3=CC=CC=C3F)Cl)OC

InChI

InChI=1S/C21H16ClFN2O5S/c1-29-17-10-14(22)16(11-18(17)30-2)24-21(26)13-9-12(25(27)28)7-8-19(13)31-20-6-4-3-5-15(20)23/h3-11H,1-2H3,(H,24,26)