N-[[4-fluoranyl-2-(trifluoromethyl)phenyl]methyl]-5-methyl-4-nitro-thiophene-2-carboxamide

Systemtic Name: N-[[4-fluoranyl-2-(trifluoromethyl)phenyl]methyl]-5-methyl-4-nitro-thiophene-2-carboxamide Openeye Name: N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-5-methyl-4-nitro-thiophene-2-carboxamide CAS Name: N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-5-methyl-4-nitro-2-thiophenecarboxamide IUPAC Name: N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-5-methyl-4-nitrothiophene-2-carboxamide Traditional Name: N-[4-fluoro-2-(trifluoromethyl)benzyl]-5-methyl-4-nitro-thiophene-2-carboxamide Formula: C14H10F4N2O3S MolecularWeight: 362.299413

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(S1)C(=O)NCC2=C(C=C(C=C2)F)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(S1)C(=O)NCC2=C(C=C(C=C2)F)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C14H10F4N2O3S/c1-7-11(20(22)23)5-12(24-7)13(21)19-6-8-2-3-9(15)4-10(8)14(16,17)18/h2-5H,6H2,1H3,(H,19,21)