2-[(2-bromanyl-4,5-dimethoxy-phenyl)methylsulfanyl]-N-[(1S,2S)-2-methylcyclohexyl]ethanamide

Systemtic Name: 2-[(2-bromanyl-4,5-dimethoxy-phenyl)methylsulfanyl]-N-[(1S,2S)-2-methylcyclohexyl]ethanamide Openeye Name: 2-[(2-bromo-4,5-dimethoxy-phenyl)methylsulfanyl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide CAS Name: 2-[(2-bromo-4,5-dimethoxyphenyl)methylthio]-N-[(1S,2S)-2-methylcyclohexyl]acetamide IUPAC Name: 2-[(2-bromo-4,5-dimethoxyphenyl)methylsulfanyl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide Traditional Name: 2-[(2-bromo-4,5-dimethoxy-benzyl)thio]-N-[(1S,2S)-2-methylcyclohexyl]acetamide Formula: C18H26BrNO3S MolecularWeight: 416.37294

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)CSCC2=CC(=C(C=C2Br)OC)OC

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=O)CSCC2=CC(=C(C=C2Br)OC)OC

InChI

InChI=1S/C18H26BrNO3S/c1-12-6-4-5-7-15(12)20-18(21)11-24-10-13-8-16(22-2)17(23-3)9-14(13)19/h8-9,12,15H,4-7,10-11H2,1-3H3,(H,20,21)/t12-,15-/m0/s1