N-[2-(phenylmethylsulfanyl)ethyl]-2-(2,3,5-trimethylphenoxy)propanamide

Systemtic Name: N-[2-(phenylmethylsulfanyl)ethyl]-2-(2,3,5-trimethylphenoxy)propanamide Openeye Name: N-(2-benzylsulfanylethyl)-2-(2,3,5-trimethylphenoxy)propanamide CAS Name: N-[2-(phenylmethylthio)ethyl]-2-(2,3,5-trimethylphenoxy)propanamide IUPAC Name: N-(2-benzylsulfanylethyl)-2-(2,3,5-trimethylphenoxy)propanamide Traditional Name: N-[2-(benzylthio)ethyl]-2-(2,3,5-trimethylphenoxy)propionamide Formula: C21H27NO2S MolecularWeight: 357.50958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OC(C)C(=O)NCCSCC2=CC=CC=C2)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OC(C)C(=O)NCCSCC2=CC=CC=C2)C)C

InChI

InChI=1S/C21H27NO2S/c1-15-12-16(2)17(3)20(13-15)24-18(4)21(23)22-10-11-25-14-19-8-6-5-7-9-19/h5-9,12-13,18H,10-11,14H2,1-4H3,(H,22,23)