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

Systemtic Name: 2-[(6-bromanyl-1,3-benzodioxol-5-yl)methylsulfanyl]-N-[(1S,2S)-2-methylcyclohexyl]ethanamide Openeye Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylsulfanyl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide CAS Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylthio]-N-[(1S,2S)-2-methylcyclohexyl]acetamide IUPAC Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylsulfanyl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide Traditional Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylthio]-N-[(1S,2S)-2-methylcyclohexyl]acetamide Formula: C17H22BrNO3S MolecularWeight: 400.33048

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)CSCC2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=O)CSCC2=CC3=C(C=C2Br)OCO3

InChI

InChI=1S/C17H22BrNO3S/c1-11-4-2-3-5-14(11)19-17(20)9-23-8-12-6-15-16(7-13(12)18)22-10-21-15/h6-7,11,14H,2-5,8-10H2,1H3,(H,19,20)/t11-,14-/m0/s1