N-methyl-N-[1-(3-nitrophenyl)ethyl]-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-ethanamide

Systemtic Name: N-methyl-N-[1-(3-nitrophenyl)ethyl]-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-ethanamide Openeye Name: N-methyl-N-[1-(3-nitrophenyl)ethyl]-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-acetamide CAS Name: N-methyl-N-[1-(3-nitrophenyl)ethyl]-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]acetamide IUPAC Name: N-methyl-N-[1-(3-nitrophenyl)ethyl]-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylacetamide Traditional Name: N-methyl-N-[1-(3-nitrophenyl)ethyl]-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]acetamide Formula: C18H16F3N3O5S MolecularWeight: 443.39695

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16F3N3O5S/c1-11(12-4-3-5-14(8-12)23(26)27)22(2)17(25)10-30-16-7-6-13(18(19,20)21)9-15(16)24(28)29/h3-9,11H,10H2,1-2H3