2-(3,4-dimethylphenyl)sulfanyl-N-[4-nitro-2-(trifluoromethyl)phenyl]propanamide

Systemtic Name: 2-(3,4-dimethylphenyl)sulfanyl-N-[4-nitro-2-(trifluoromethyl)phenyl]propanamide Openeye Name: 2-(3,4-dimethylphenyl)sulfanyl-N-[4-nitro-2-(trifluoromethyl)phenyl]propanamide CAS Name: 2-[(3,4-dimethylphenyl)thio]-N-[4-nitro-2-(trifluoromethyl)phenyl]propanamide IUPAC Name: 2-(3,4-dimethylphenyl)sulfanyl-N-[4-nitro-2-(trifluoromethyl)phenyl]propanamide Traditional Name: 2-[(3,4-dimethylphenyl)thio]-N-[4-nitro-2-(trifluoromethyl)phenyl]propionamide Formula: C18H17F3N2O3S MolecularWeight: 398.39939

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC(C)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(F)(F)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)SC(C)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(F)(F)F)C

InChI

InChI=1S/C18H17F3N2O3S/c1-10-4-6-14(8-11(10)2)27-12(3)17(24)22-16-7-5-13(23(25)26)9-15(16)18(19,20)21/h4-9,12H,1-3H3,(H,22,24)