3,5-dinitro-N-[2,4,6-tris(fluoranyl)phenyl]benzenecarbothioamide

Systemtic Name: 3,5-dinitro-N-[2,4,6-tris(fluoranyl)phenyl]benzenecarbothioamide Openeye Name: 3,5-dinitro-N-(2,4,6-trifluorophenyl)benzenecarbothioamide CAS Name: 3,5-dinitro-N-(2,4,6-trifluorophenyl)benzenecarbothioamide IUPAC Name: 3,5-dinitro-N-(2,4,6-trifluorophenyl)benzenecarbothioamide Traditional Name: 3,5-dinitro-N-(2,4,6-trifluorophenyl)thiobenzamide Formula: C13H6F3N3O4S MolecularWeight: 357.26465

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=S)NC2=C(C=C(C=C2F)F)F

Isomeric SMILES

C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=S)NC2=C(C=C(C=C2F)F)F

InChI

InChI=1S/C13H6F3N3O4S/c14-7-3-10(15)12(11(16)4-7)17-13(24)6-1-8(18(20)21)5-9(2-6)19(22)23/h1-5H,(H,17,24)