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

Systemtic Name: N-methyl-N-[3-[4-(oxidanylcarbamoyl)phenyl]prop-2-ynyl]-1-benzothiophene-2-carboxamide Openeye Name: N-[3-[4-(hydroxycarbamoyl)phenyl]prop-2-ynyl]-N-methyl-benzothiophene-2-carboxamide CAS Name: N-[3-[4-[(hydroxyamino)-oxomethyl]phenyl]prop-2-ynyl]-N-methyl-1-benzothiophene-2-carboxamide IUPAC Name: N-[3-[4-(hydroxycarbamoyl)phenyl]prop-2-ynyl]-N-methyl-1-benzothiophene-2-carboxamide Traditional Name: N-[3-[4-(hydroxycarbamoyl)phenyl]prop-2-ynyl]-N-methyl-benzothiophene-2-carboxamide Formula: C20H16N2O3S MolecularWeight: 364.41764

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC#CC1=CC=C(C=C1)C(=O)NO)C(=O)C2=CC3=CC=CC=C3S2

Isomeric SMILES

CN(CC#CC1=CC=C(C=C1)C(=O)NO)C(=O)C2=CC3=CC=CC=C3S2

InChI

InChI=1S/C20H16N2O3S/c1-22(20(24)18-13-16-6-2-3-7-17(16)26-18)12-4-5-14-8-10-15(11-9-14)19(23)21-25/h2-3,6-11,13,25H,12H2,1H3,(H,21,23)