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

Systemtic Name: 3-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-cyclohexyl-propanamide Openeye Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-cyclohexyl-propanamide CAS Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-N-cyclohexylpropanamide IUPAC Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-cyclohexylpropanamide Traditional Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-N-cyclohexyl-propionamide Formula: C18H24BrNO3S MolecularWeight: 414.35706

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CCSCC2=CC3=C(C=C2Br)OCCO3

Isomeric SMILES

C1CCC(CC1)NC(=O)CCSCC2=CC3=C(C=C2Br)OCCO3

InChI

InChI=1S/C18H24BrNO3S/c19-15-11-17-16(22-7-8-23-17)10-13(15)12-24-9-6-18(21)20-14-4-2-1-3-5-14/h10-11,14H,1-9,12H2,(H,20,21)