3-[[2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylethanoylamino]methyl]-N-phenyl-benzamide

Systemtic Name: 3-[[2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylethanoylamino]methyl]-N-phenyl-benzamide Openeye Name: 3-[[[2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylacetyl]amino]methyl]-N-phenyl-benzamide CAS Name: 3-[[[2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]-1-oxoethyl]amino]methyl]-N-phenylbenzamide IUPAC Name: 3-[[[2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylacetyl]amino]methyl]-N-phenylbenzamide Traditional Name: 3-[[[2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]acetyl]amino]methyl]-N-phenyl-benzamide Formula: C23H18F3N3O4S MolecularWeight: 489.46693

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)CNC(=O)CSC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)CNC(=O)CSC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C23H18F3N3O4S/c24-23(25,26)17-9-10-20(19(12-17)29(32)33)34-14-21(30)27-13-15-5-4-6-16(11-15)22(31)28-18-7-2-1-3-8-18/h1-12H,13-14H2,(H,27,30)(H,28,31)