3-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanoyl-(4-fluorophenyl)amino]propanamide

Systemtic Name: 3-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanoyl-(4-fluorophenyl)amino]propanamide Openeye Name: 3-(N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]-4-fluoro-anilino)propanamide CAS Name: 3-(N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-1-oxoethyl]-4-fluoroanilino)propanamide IUPAC Name: 3-(N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]-4-fluoroanilino)propanamide Traditional Name: 3-(N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)acetyl]-4-fluoro-anilino)propionamide Formula: C19H19FN2O4S MolecularWeight: 390.428563

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)SCC(=O)N(CCC(=O)N)C3=CC=C(C=C3)F

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)SCC(=O)N(CCC(=O)N)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H19FN2O4S/c20-13-1-3-14(4-2-13)22(8-7-18(21)23)19(24)12-27-15-5-6-16-17(11-15)26-10-9-25-16/h1-6,11H,7-10,12H2,(H2,21,23)