N-[2-(3,4-dimethoxyphenyl)ethyl]-5,5-bis(methylsulfanyl)pentanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5,5-bis(methylsulfanyl)pentanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5,5-bis(methylsulfanyl)pentanamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5,5-bis(methylthio)pentanamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5,5-bis(methylsulfanyl)pentanamide Traditional Name: N-homoveratryl-5,5-bis(methylthio)valeramide Formula: C17H27NO3S2 MolecularWeight: 357.53118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CCCC(SC)SC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CCCC(SC)SC)OC

InChI

InChI=1S/C17H27NO3S2/c1-20-14-9-8-13(12-15(14)21-2)10-11-18-16(19)6-5-7-17(22-3)23-4/h8-9,12,17H,5-7,10-11H2,1-4H3,(H,18,19)