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

Systemtic Name: 3-[2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylethanoylamino]benzamide Openeye Name: 3-[[2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylacetyl]amino]benzamide CAS Name: 3-[[2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: 3-[[2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylacetyl]amino]benzamide Traditional Name: 3-[[2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]acetyl]amino]benzamide Formula: C16H12F3N3O4S MolecularWeight: 399.34439

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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(=O)N

Isomeric SMILES

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

InChI

InChI=1S/C16H12F3N3O4S/c17-16(18,19)10-4-5-13(12(7-10)22(25)26)27-8-14(23)21-11-3-1-2-9(6-11)15(20)24/h1-7H,8H2,(H2,20,24)(H,21,23)