N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxidanylidene-ethyl]-N-ethyl-4-fluoranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxidanylidene-ethyl]-N-ethyl-4-fluoranyl-1-benzothiophene-2-carboxamide Openeye Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxo-ethyl]-N-ethyl-4-fluoro-benzothiophene-2-carboxamide CAS Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-N-ethyl-4-fluoro-1-benzothiophene-2-carboxamide IUPAC Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-N-ethyl-4-fluoro-1-benzothiophene-2-carboxamide Traditional Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-keto-ethyl]-N-ethyl-4-fluoro-benzothiophene-2-carboxamide Formula: C21H19FN2O4S MolecularWeight: 414.449963

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1=CC2=C(C=C1)OCCO2)C(=O)C3=CC4=C(C=CC=C4S3)F

Isomeric SMILES

CCN(CC(=O)NC1=CC2=C(C=C1)OCCO2)C(=O)C3=CC4=C(C=CC=C4S3)F

InChI

InChI=1S/C21H19FN2O4S/c1-2-24(21(26)19-11-14-15(22)4-3-5-18(14)29-19)12-20(25)23-13-6-7-16-17(10-13)28-9-8-27-16/h3-7,10-11H,2,8-9,12H2,1H3,(H,23,25)