N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-4-fluoranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-4-fluoranyl-1-benzothiophene-2-carboxamide Openeye Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-4-fluoro-benzothiophene-2-carboxamide CAS Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-4-fluoro-1-benzothiophene-2-carboxamide IUPAC Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-4-fluoro-1-benzothiophene-2-carboxamide Traditional Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-4-fluoro-benzothiophene-2-carboxamide Formula: C19H17BrFNO3S MolecularWeight: 438.310583

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)C2=CC3=C(C=CC=C3S2)F)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)C2=CC3=C(C=CC=C3S2)F)Br)OC

InChI

InChI=1S/C19H17BrFNO3S/c1-24-15-8-11(13(20)10-16(15)25-2)6-7-22-19(23)18-9-12-14(21)4-3-5-17(12)26-18/h3-5,8-10H,6-7H2,1-2H3,(H,22,23)