N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(phenylmethylsulfanyl)propanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(phenylmethylsulfanyl)propanamide Openeye Name: 3-benzylsulfanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(phenylmethylthio)propanamide IUPAC Name: 3-benzylsulfanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide Traditional Name: 3-(benzylthio)-N-homoveratryl-propionamide Formula: C20H25NO3S MolecularWeight: 359.4824

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CCSCC2=CC=CC=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CCSCC2=CC=CC=C2)OC

InChI

InChI=1S/C20H25NO3S/c1-23-18-9-8-16(14-19(18)24-2)10-12-21-20(22)11-13-25-15-17-6-4-3-5-7-17/h3-9,14H,10-13,15H2,1-2H3,(H,21,22)