4-fluoranyl-3-(methoxymethyl)-N-[3-[methyl(phenyl)amino]propyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 4-fluoranyl-3-(methoxymethyl)-N-[3-[methyl(phenyl)amino]propyl]-1-benzothiophene-2-carboxamide Openeye Name: 4-fluoro-3-(methoxymethyl)-N-[3-(N-methylanilino)propyl]benzothiophene-2-carboxamide CAS Name: 4-fluoro-3-(methoxymethyl)-N-[3-(N-methylanilino)propyl]-1-benzothiophene-2-carboxamide IUPAC Name: 4-fluoro-3-(methoxymethyl)-N-[3-(N-methylanilino)propyl]-1-benzothiophene-2-carboxamide Traditional Name: 4-fluoro-3-(methoxymethyl)-N-[3-(N-methylanilino)propyl]benzothiophene-2-carboxamide Formula: C21H23FN2O2S MolecularWeight: 386.482923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)C1=C(C2=C(C=CC=C2S1)F)COC)C3=CC=CC=C3

Isomeric SMILES

CN(CCCNC(=O)C1=C(C2=C(C=CC=C2S1)F)COC)C3=CC=CC=C3

InChI

InChI=1S/C21H23FN2O2S/c1-24(15-8-4-3-5-9-15)13-7-12-23-21(25)20-16(14-26-2)19-17(22)10-6-11-18(19)27-20/h3-6,8-11H,7,12-14H2,1-2H3,(H,23,25)