N-[[6-(2,6-dimethylmorpholin-4-yl)pyridin-3-yl]methyl]-5-fluoranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[[6-(2,6-dimethylmorpholin-4-yl)pyridin-3-yl]methyl]-5-fluoranyl-1-benzothiophene-2-carboxamide Openeye Name: N-[[6-(2,6-dimethylmorpholin-4-yl)-3-pyridyl]methyl]-5-fluoro-benzothiophene-2-carboxamide CAS Name: N-[[6-(2,6-dimethyl-4-morpholinyl)-3-pyridinyl]methyl]-5-fluoro-1-benzothiophene-2-carboxamide IUPAC Name: N-[[6-(2,6-dimethylmorpholin-4-yl)pyridin-3-yl]methyl]-5-fluoro-1-benzothiophene-2-carboxamide Traditional Name: N-[[6-(2,6-dimethylmorpholino)-3-pyridyl]methyl]-5-fluoro-benzothiophene-2-carboxamide Formula: C21H22FN3O2S MolecularWeight: 399.481683

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C2=NC=C(C=C2)CNC(=O)C3=CC4=C(S3)C=CC(=C4)F

Isomeric SMILES

CC1CN(CC(O1)C)C2=NC=C(C=C2)CNC(=O)C3=CC4=C(S3)C=CC(=C4)F

InChI

InChI=1S/C21H22FN3O2S/c1-13-11-25(12-14(2)27-13)20-6-3-15(9-23-20)10-24-21(26)19-8-16-7-17(22)4-5-18(16)28-19/h3-9,13-14H,10-12H2,1-2H3,(H,24,26)