N-(5-acetamido-2-methoxy-phenyl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-benzamide

Systemtic Name: N-(5-acetamido-2-methoxy-phenyl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-benzamide Openeye Name: N-(5-acetamido-2-methoxy-phenyl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-benzamide CAS Name: N-(5-acetamido-2-methoxyphenyl)-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]benzamide IUPAC Name: N-(5-acetamido-2-methoxyphenyl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylbenzamide Traditional Name: N-(5-acetamido-2-methoxy-phenyl)-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]benzamide Formula: C23H18F3N3O5S MolecularWeight: 505.46633

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)C2=CC=CC=C2SC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)C2=CC=CC=C2SC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C23H18F3N3O5S/c1-13(30)27-15-8-9-19(34-2)17(12-15)28-22(31)16-5-3-4-6-20(16)35-21-10-7-14(23(24,25)26)11-18(21)29(32)33/h3-12H,1-2H3,(H,27,30)(H,28,31)