N-(4-methyl-3-nitro-phenyl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-ethanamide

Systemtic Name: N-(4-methyl-3-nitro-phenyl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-ethanamide Openeye Name: N-(4-methyl-3-nitro-phenyl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-acetamide CAS Name: N-(4-methyl-3-nitrophenyl)-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]acetamide IUPAC Name: N-(4-methyl-3-nitrophenyl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylacetamide Traditional Name: N-(4-methyl-3-nitro-phenyl)-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]acetamide Formula: C16H12F3N3O5S MolecularWeight: 415.34379

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H12F3N3O5S/c1-9-2-4-11(7-12(9)21(24)25)20-15(23)8-28-14-5-3-10(16(17,18)19)6-13(14)22(26)27/h2-7H,8H2,1H3,(H,20,23)