N-(3-cyanophenyl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-ethanamide

Systemtic Name: N-(3-cyanophenyl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-ethanamide Openeye Name: N-(3-cyanophenyl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-acetamide CAS Name: N-(3-cyanophenyl)-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]acetamide IUPAC Name: N-(3-cyanophenyl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylacetamide Traditional Name: N-(3-cyanophenyl)-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]acetamide Formula: C16H10F3N3O3S MolecularWeight: 381.32911

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CSC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CSC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C#N

InChI

InChI=1S/C16H10F3N3O3S/c17-16(18,19)11-4-5-14(13(7-11)22(24)25)26-9-15(23)21-12-3-1-2-10(6-12)8-20/h1-7H,9H2,(H,21,23)