4-fluoranyl-N-[[3-(methylcarbamoyl)phenyl]methyl]-3-(phenoxymethyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 4-fluoranyl-N-[[3-(methylcarbamoyl)phenyl]methyl]-3-(phenoxymethyl)-1-benzothiophene-2-carboxamide Openeye Name: 4-fluoro-N-[[3-(methylcarbamoyl)phenyl]methyl]-3-(phenoxymethyl)benzothiophene-2-carboxamide CAS Name: 4-fluoro-N-[[3-(methylcarbamoyl)phenyl]methyl]-3-(phenoxymethyl)-1-benzothiophene-2-carboxamide IUPAC Name: 4-fluoro-N-[[3-(methylcarbamoyl)phenyl]methyl]-3-(phenoxymethyl)-1-benzothiophene-2-carboxamide Traditional Name: 4-fluoro-N-[3-(methylcarbamoyl)benzyl]-3-(phenoxymethyl)benzothiophene-2-carboxamide Formula: C25H21FN2O3S MolecularWeight: 448.509243

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H21FN2O3S/c1-27-24(29)17-8-5-7-16(13-17)14-28-25(30)23-19(15-31-18-9-3-2-4-10-18)22-20(26)11-6-12-21(22)32-23/h2-13H,14-15H2,1H3,(H,27,29)(H,28,30)