N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-5-fluoranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-5-fluoranyl-1-benzothiophene-2-carboxamide Openeye Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-5-fluoro-benzothiophene-2-carboxamide CAS Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-5-fluoro-1-benzothiophene-2-carboxamide IUPAC Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-5-fluoro-1-benzothiophene-2-carboxamide Traditional Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-5-fluoro-benzothiophene-2-carboxamide Formula: C20H18FNO3S MolecularWeight: 371.425223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCCO2)NC(=O)C3=CC4=C(S3)C=CC(=C4)F

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCCCO2)NC(=O)C3=CC4=C(S3)C=CC(=C4)F

InChI

InChI=1S/C20H18FNO3S/c1-12(13-3-5-16-17(10-13)25-8-2-7-24-16)22-20(23)19-11-14-9-15(21)4-6-18(14)26-19/h3-6,9-12H,2,7-8H2,1H3,(H,22,23)