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

Systemtic Name: N-[[2-(dimethylamino)pyridin-4-yl]methyl]-4-fluoranyl-3-(phenoxymethyl)-1-benzothiophene-2-carboxamide Openeye Name: N-[[2-(dimethylamino)-4-pyridyl]methyl]-4-fluoro-3-(phenoxymethyl)benzothiophene-2-carboxamide CAS Name: N-[[2-(dimethylamino)-4-pyridinyl]methyl]-4-fluoro-3-(phenoxymethyl)-1-benzothiophene-2-carboxamide IUPAC Name: N-[[2-(dimethylamino)pyridin-4-yl]methyl]-4-fluoro-3-(phenoxymethyl)-1-benzothiophene-2-carboxamide Traditional Name: N-[[2-(dimethylamino)-4-pyridyl]methyl]-4-fluoro-3-(phenoxymethyl)benzothiophene-2-carboxamide Formula: C24H22FN3O2S MolecularWeight: 435.513783

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H22FN3O2S/c1-28(2)21-13-16(11-12-26-21)14-27-24(29)23-18(15-30-17-7-4-3-5-8-17)22-19(25)9-6-10-20(22)31-23/h3-13H,14-15H2,1-2H3,(H,27,29)