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

Systemtic Name: 3-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-(methylcarbamoyl)propanamide Openeye Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-(methylcarbamoyl)propanamide CAS Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-N-(methylcarbamoyl)propanamide IUPAC Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-(methylcarbamoyl)propanamide Traditional Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-N-(methylcarbamoyl)propionamide Formula: C14H17BrN2O4S MolecularWeight: 389.26478

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(=O)CCSCC1=CC2=C(C=C1Br)OCCO2

Isomeric SMILES

CNC(=O)NC(=O)CCSCC1=CC2=C(C=C1Br)OCCO2

InChI

InChI=1S/C14H17BrN2O4S/c1-16-14(19)17-13(18)2-5-22-8-9-6-11-12(7-10(9)15)21-4-3-20-11/h6-7H,2-5,8H2,1H3,(H2,16,17,18,19)