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

Systemtic Name: 2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanethioamide Openeye Name: 2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanethioamide CAS Name: 2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanethioamide IUPAC Name: 2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanethioamide Traditional Name: 2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]thiopropionamide Formula: C11H11F3N2O2S MolecularWeight: 292.27745

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=S)NC1=CC(=C(C=C1)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

CC(C)C(=S)NC1=CC(=C(C=C1)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C11H11F3N2O2S/c1-6(2)10(19)15-7-3-4-9(16(17)18)8(5-7)11(12,13)14/h3-6H,1-2H3,(H,15,19)