N-(4,5-dimethoxy-2-methyl-phenyl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-ethanamide

Systemtic Name: N-(4,5-dimethoxy-2-methyl-phenyl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-ethanamide Openeye Name: N-(4,5-dimethoxy-2-methyl-phenyl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-acetamide CAS Name: N-(4,5-dimethoxy-2-methylphenyl)-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]acetamide IUPAC Name: N-(4,5-dimethoxy-2-methylphenyl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylacetamide Traditional Name: N-(4,5-dimethoxy-2-methyl-phenyl)-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]acetamide Formula: C18H17F3N2O5S MolecularWeight: 430.39819

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=O)CSC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1NC(=O)CSC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C18H17F3N2O5S/c1-10-6-14(27-2)15(28-3)8-12(10)22-17(24)9-29-16-5-4-11(18(19,20)21)7-13(16)23(25)26/h4-8H,9H2,1-3H3,(H,22,24)