2-(1,3-benzodioxol-5-ylmethylsulfanyl)-N-[(1S)-1-(4-ethylphenyl)ethyl]ethanamide

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-N-[(1S)-1-(4-ethylphenyl)ethyl]ethanamide Openeye Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-N-[(1S)-1-(4-ethylphenyl)ethyl]acetamide CAS Name: 2-(1,3-benzodioxol-5-ylmethylthio)-N-[(1S)-1-(4-ethylphenyl)ethyl]acetamide IUPAC Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-N-[(1S)-1-(4-ethylphenyl)ethyl]acetamide Traditional Name: N-[(1S)-1-(4-ethylphenyl)ethyl]-2-(piperonylthio)acetamide Formula: C20H23NO3S MolecularWeight: 357.46652

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C)NC(=O)CSCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](C)NC(=O)CSCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H23NO3S/c1-3-15-4-7-17(8-5-15)14(2)21-20(22)12-25-11-16-6-9-18-19(10-16)24-13-23-18/h4-10,14H,3,11-13H2,1-2H3,(H,21,22)/t14-/m0/s1