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

Systemtic Name: (2S)-2-azanyl-N-[(3,4-dimethoxyphenyl)methyl]-4-methylsulfanyl-butanamide Openeye Name: (2S)-2-amino-N-[(3,4-dimethoxyphenyl)methyl]-4-methylsulfanyl-butanamide CAS Name: (2S)-2-amino-N-[(3,4-dimethoxyphenyl)methyl]-4-(methylthio)butanamide IUPAC Name: (2S)-2-amino-N-[(3,4-dimethoxyphenyl)methyl]-4-methylsulfanylbutanamide Traditional Name: (2S)-2-amino-4-(methylthio)-N-veratryl-butyramide Formula: C14H22N2O3S MolecularWeight: 298.40108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N2O3S/c1-18-12-5-4-10(8-13(12)19-2)9-16-14(17)11(15)6-7-20-3/h4-5,8,11H,6-7,9,15H2,1-3H3,(H,16,17)/t11-/m0/s1