N-[[2-(dimethylamino)pyridin-3-yl]methyl]-5-fluoranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[[2-(dimethylamino)pyridin-3-yl]methyl]-5-fluoranyl-1-benzothiophene-2-carboxamide Openeye Name: N-[[2-(dimethylamino)-3-pyridyl]methyl]-5-fluoro-benzothiophene-2-carboxamide CAS Name: N-[[2-(dimethylamino)-3-pyridinyl]methyl]-5-fluoro-1-benzothiophene-2-carboxamide IUPAC Name: N-[[2-(dimethylamino)pyridin-3-yl]methyl]-5-fluoro-1-benzothiophene-2-carboxamide Traditional Name: N-[[2-(dimethylamino)-3-pyridyl]methyl]-5-fluoro-benzothiophene-2-carboxamide Formula: C17H16FN3OS MolecularWeight: 329.391843

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=CC=N1)CNC(=O)C2=CC3=C(S2)C=CC(=C3)F

Isomeric SMILES

CN(C)C1=C(C=CC=N1)CNC(=O)C2=CC3=C(S2)C=CC(=C3)F

InChI

InChI=1S/C17H16FN3OS/c1-21(2)16-11(4-3-7-19-16)10-20-17(22)15-9-12-8-13(18)5-6-14(12)23-15/h3-9H,10H2,1-2H3,(H,20,22)