3-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-(2-fluorophenyl)propanamide

Systemtic Name: 3-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-(2-fluorophenyl)propanamide Openeye Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-(2-fluorophenyl)propanamide CAS Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-N-(2-fluorophenyl)propanamide IUPAC Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-(2-fluorophenyl)propanamide Traditional Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-N-(2-fluorophenyl)propionamide Formula: C18H17BrFNO3S MolecularWeight: 426.299883

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)Br)CSCCC(=O)NC3=CC=CC=C3F

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)Br)CSCCC(=O)NC3=CC=CC=C3F

InChI

InChI=1S/C18H17BrFNO3S/c19-13-10-17-16(23-6-7-24-17)9-12(13)11-25-8-5-18(22)21-15-4-2-1-3-14(15)20/h1-4,9-10H,5-8,11H2,(H,21,22)