N-[3-[4-(oxidanylcarbamoyl)phenyl]prop-2-ynyl]-4-(trifluoromethyl)-1-benzothiophene-2-carboxamide

Systemtic Name: N-[3-[4-(oxidanylcarbamoyl)phenyl]prop-2-ynyl]-4-(trifluoromethyl)-1-benzothiophene-2-carboxamide Openeye Name: N-[3-[4-(hydroxycarbamoyl)phenyl]prop-2-ynyl]-4-(trifluoromethyl)benzothiophene-2-carboxamide CAS Name: N-[3-[4-[(hydroxyamino)-oxomethyl]phenyl]prop-2-ynyl]-4-(trifluoromethyl)-1-benzothiophene-2-carboxamide IUPAC Name: N-[3-[4-(hydroxycarbamoyl)phenyl]prop-2-ynyl]-4-(trifluoromethyl)-1-benzothiophene-2-carboxamide Traditional Name: N-[3-[4-(hydroxycarbamoyl)phenyl]prop-2-ynyl]-4-(trifluoromethyl)benzothiophene-2-carboxamide Formula: C20H13F3N2O3S MolecularWeight: 418.38903

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=C(SC2=C1)C(=O)NCC#CC3=CC=C(C=C3)C(=O)NO)C(F)(F)F

Isomeric SMILES

C1=CC(=C2C=C(SC2=C1)C(=O)NCC#CC3=CC=C(C=C3)C(=O)NO)C(F)(F)F

InChI

InChI=1S/C20H13F3N2O3S/c21-20(22,23)15-4-1-5-16-14(15)11-17(29-16)19(27)24-10-2-3-12-6-8-13(9-7-12)18(26)25-28/h1,4-9,11,28H,10H2,(H,24,27)(H,25,26)