3-nitro-4-[2-oxidanylidene-2-[[4-(trifluoromethyloxy)phenyl]amino]ethyl]sulfanyl-benzamide

Systemtic Name: 3-nitro-4-[2-oxidanylidene-2-[[4-(trifluoromethyloxy)phenyl]amino]ethyl]sulfanyl-benzamide Openeye Name: 3-nitro-4-[2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl]sulfanyl-benzamide CAS Name: 3-nitro-4-[[2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl]thio]benzamide IUPAC Name: 3-nitro-4-[2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl]sulfanylbenzamide Traditional Name: 4-[[2-keto-2-[4-(trifluoromethoxy)anilino]ethyl]thio]-3-nitro-benzamide Formula: C16H12F3N3O5S MolecularWeight: 415.34379

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)CSC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])OC(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1NC(=O)CSC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])OC(F)(F)F

InChI

InChI=1S/C16H12F3N3O5S/c17-16(18,19)27-11-4-2-10(3-5-11)21-14(23)8-28-13-6-1-9(15(20)24)7-12(13)22(25)26/h1-7H,8H2,(H2,20,24)(H,21,23)