(2S)-2-azanyl-4-methylsulfanyl-N-(3,4,5-trimethoxyphenyl)butanamide

Systemtic Name: (2S)-2-azanyl-4-methylsulfanyl-N-(3,4,5-trimethoxyphenyl)butanamide Openeye Name: (2S)-2-amino-4-methylsulfanyl-N-(3,4,5-trimethoxyphenyl)butanamide CAS Name: (2S)-2-amino-4-(methylthio)-N-(3,4,5-trimethoxyphenyl)butanamide IUPAC Name: (2S)-2-amino-4-methylsulfanyl-N-(3,4,5-trimethoxyphenyl)butanamide Traditional Name: (2S)-2-amino-4-(methylthio)-N-(3,4,5-trimethoxyphenyl)butyramide Formula: C14H22N2O4S MolecularWeight: 314.40048

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=O)C(CCSC)N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=O)[C@H](CCSC)N

InChI

InChI=1S/C14H22N2O4S/c1-18-11-7-9(8-12(19-2)13(11)20-3)16-14(17)10(15)5-6-21-4/h7-8,10H,5-6,15H2,1-4H3,(H,16,17)/t10-/m0/s1