N-[2-(3,4-dimethoxyphenyl)ethyl]-4-fluoranyl-3-(methoxymethyl)-1-benzothiophene-2-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-fluoranyl-3-(methoxymethyl)-1-benzothiophene-2-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-fluoro-3-(methoxymethyl)benzothiophene-2-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-fluoro-3-(methoxymethyl)-1-benzothiophene-2-carboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-fluoro-3-(methoxymethyl)-1-benzothiophene-2-carboxamide Traditional Name: 4-fluoro-N-homoveratryl-3-(methoxymethyl)benzothiophene-2-carboxamide Formula: C21H22FNO4S MolecularWeight: 403.467083

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C(SC2=CC=CC(=C21)F)C(=O)NCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

COCC1=C(SC2=CC=CC(=C21)F)C(=O)NCCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H22FNO4S/c1-25-12-14-19-15(22)5-4-6-18(19)28-20(14)21(24)23-10-9-13-7-8-16(26-2)17(11-13)27-3/h4-8,11H,9-10,12H2,1-3H3,(H,23,24)