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

Systemtic Name: N-(3-acetamido-2-methyl-phenyl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-ethanamide Openeye Name: N-(3-acetamido-2-methyl-phenyl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-acetamide CAS Name: N-(3-acetamido-2-methylphenyl)-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]acetamide IUPAC Name: N-(3-acetamido-2-methylphenyl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylacetamide Traditional Name: N-(3-acetamido-2-methyl-phenyl)-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]acetamide Formula: C18H16F3N3O4S MolecularWeight: 427.39755

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)CSC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])NC(=O)C

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)CSC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])NC(=O)C

InChI

InChI=1S/C18H16F3N3O4S/c1-10-13(22-11(2)25)4-3-5-14(10)23-17(26)9-29-16-7-6-12(18(19,20)21)8-15(16)24(27)28/h3-8H,9H2,1-2H3,(H,22,25)(H,23,26)