2-[(5-ethanoyl-2-ethoxy-phenyl)methylsulfanyl]-N-[(1S,2S)-2-methylcyclohexyl]ethanamide

Systemtic Name: 2-[(5-ethanoyl-2-ethoxy-phenyl)methylsulfanyl]-N-[(1S,2S)-2-methylcyclohexyl]ethanamide Openeye Name: 2-[(5-acetyl-2-ethoxy-phenyl)methylsulfanyl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide CAS Name: 2-[(5-acetyl-2-ethoxyphenyl)methylthio]-N-[(1S,2S)-2-methylcyclohexyl]acetamide IUPAC Name: 2-[(5-acetyl-2-ethoxyphenyl)methylsulfanyl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide Traditional Name: 2-[(5-acetyl-2-ethoxy-benzyl)thio]-N-[(1S,2S)-2-methylcyclohexyl]acetamide Formula: C20H29NO3S MolecularWeight: 363.51416

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)CSCC(=O)NC2CCCCC2C

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)CSCC(=O)N[C@H]2CCCC[C@@H]2C

InChI

InChI=1S/C20H29NO3S/c1-4-24-19-10-9-16(15(3)22)11-17(19)12-25-13-20(23)21-18-8-6-5-7-14(18)2/h9-11,14,18H,4-8,12-13H2,1-3H3,(H,21,23)/t14-,18-/m0/s1