(2S)-2-azanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methylsulfanyl-butanamide

Systemtic Name: (2S)-2-azanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methylsulfanyl-butanamide Openeye Name: (2S)-2-amino-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methylsulfanyl-butanamide CAS Name: (2S)-2-amino-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(methylthio)butanamide IUPAC Name: (2S)-2-amino-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methylsulfanylbutanamide Traditional Name: (2S)-2-amino-N-homoveratryl-4-(methylthio)butyramide Formula: C15H24N2O3S MolecularWeight: 312.42766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C(CCSC)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)[C@H](CCSC)N)OC

InChI

InChI=1S/C15H24N2O3S/c1-19-13-5-4-11(10-14(13)20-2)6-8-17-15(18)12(16)7-9-21-3/h4-5,10,12H,6-9,16H2,1-3H3,(H,17,18)/t12-/m0/s1