2-[(6-bromanyl-1,3-benzodioxol-5-yl)methylsulfanyl]-N-[(2S)-pentan-2-yl]ethanamide

Systemtic Name: 2-[(6-bromanyl-1,3-benzodioxol-5-yl)methylsulfanyl]-N-[(2S)-pentan-2-yl]ethanamide Openeye Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylsulfanyl]-N-[(1S)-1-methylbutyl]acetamide CAS Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylthio]-N-[(2S)-pentan-2-yl]acetamide IUPAC Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylsulfanyl]-N-[(2S)-pentan-2-yl]acetamide Traditional Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylthio]-N-[(1S)-1-methylbutyl]acetamide Formula: C15H20BrNO3S MolecularWeight: 374.2932

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)CSCC1=CC2=C(C=C1Br)OCO2

Isomeric SMILES

CCC[C@H](C)NC(=O)CSCC1=CC2=C(C=C1Br)OCO2

InChI

InChI=1S/C15H20BrNO3S/c1-3-4-10(2)17-15(18)8-21-7-11-5-13-14(6-12(11)16)20-9-19-13/h5-6,10H,3-4,7-9H2,1-2H3,(H,17,18)/t10-/m0/s1