(2S)-2-azanyl-N-(1,3-benzodioxol-5-yl)-4-methylsulfanyl-butanamide

Systemtic Name: (2S)-2-azanyl-N-(1,3-benzodioxol-5-yl)-4-methylsulfanyl-butanamide Openeye Name: (2S)-2-amino-N-(1,3-benzodioxol-5-yl)-4-methylsulfanyl-butanamide CAS Name: (2S)-2-amino-N-(1,3-benzodioxol-5-yl)-4-(methylthio)butanamide IUPAC Name: (2S)-2-amino-N-(1,3-benzodioxol-5-yl)-4-methylsulfanylbutanamide Traditional Name: (2S)-2-amino-N-(1,3-benzodioxol-5-yl)-4-(methylthio)butyramide Formula: C12H16N2O3S MolecularWeight: 268.33204

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CC2=C(C=C1)OCO2)N

Isomeric SMILES

CSCC[C@@H](C(=O)NC1=CC2=C(C=C1)OCO2)N

InChI

InChI=1S/C12H16N2O3S/c1-18-5-4-9(13)12(15)14-8-2-3-10-11(6-8)17-7-16-10/h2-3,6,9H,4-5,7,13H2,1H3,(H,14,15)/t9-/m0/s1