4-fluoranyl-N-[(2-methoxypyridin-4-yl)methyl]-3-(phenoxymethyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 4-fluoranyl-N-[(2-methoxypyridin-4-yl)methyl]-3-(phenoxymethyl)-1-benzothiophene-2-carboxamide Openeye Name: 4-fluoro-N-[(2-methoxy-4-pyridyl)methyl]-3-(phenoxymethyl)benzothiophene-2-carboxamide CAS Name: 4-fluoro-N-[(2-methoxy-4-pyridinyl)methyl]-3-(phenoxymethyl)-1-benzothiophene-2-carboxamide IUPAC Name: 4-fluoro-N-[(2-methoxypyridin-4-yl)methyl]-3-(phenoxymethyl)-1-benzothiophene-2-carboxamide Traditional Name: 4-fluoro-N-[(2-methoxy-4-pyridyl)methyl]-3-(phenoxymethyl)benzothiophene-2-carboxamide Formula: C23H19FN2O3S MolecularWeight: 422.471963

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=CC(=C1)CNC(=O)C2=C(C3=C(C=CC=C3S2)F)COC4=CC=CC=C4

Isomeric SMILES

COC1=NC=CC(=C1)CNC(=O)C2=C(C3=C(C=CC=C3S2)F)COC4=CC=CC=C4

InChI

InChI=1S/C23H19FN2O3S/c1-28-20-12-15(10-11-25-20)13-26-23(27)22-17(14-29-16-6-3-2-4-7-16)21-18(24)8-5-9-19(21)30-22/h2-12H,13-14H2,1H3,(H,26,27)