4-azanyl-3-nitro-N-[2-[2,2,2-tris(fluoranyl)ethylsulfanyl]phenyl]benzamide

Systemtic Name: 4-azanyl-3-nitro-N-[2-[2,2,2-tris(fluoranyl)ethylsulfanyl]phenyl]benzamide Openeye Name: 4-amino-3-nitro-N-[2-(2,2,2-trifluoroethylsulfanyl)phenyl]benzamide CAS Name: 4-amino-3-nitro-N-[2-(2,2,2-trifluoroethylthio)phenyl]benzamide IUPAC Name: 4-amino-3-nitro-N-[2-(2,2,2-trifluoroethylsulfanyl)phenyl]benzamide Traditional Name: 4-amino-3-nitro-N-[2-(2,2,2-trifluoroethylthio)phenyl]benzamide Formula: C15H12F3N3O3S MolecularWeight: 371.33429

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12F3N3O3S/c16-15(17,18)8-25-13-4-2-1-3-11(13)20-14(22)9-5-6-10(19)12(7-9)21(23)24/h1-7H,8,19H2,(H,20,22)