2-azanyl-4-methylsulfanyl-butanoic acid; phenylmethanesulfonamide

Systemtic Name: 2-azanyl-4-methylsulfanyl-butanoic acid; phenylmethanesulfonamide Openeye Name: 2-amino-4-methylsulfanyl-butanoic acid; phenylmethanesulfonamide CAS Name: 2-amino-4-(methylthio)butanoic acid; phenylmethanesulfonamide IUPAC Name: 2-amino-4-methylsulfanylbutanoic acid; phenylmethanesulfonamide Traditional Name: 2-amino-4-(methylthio)butyric acid; phenylmethanesulfonamide Formula: C12H20N2O4S2 MolecularWeight: 320.4282

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)N.C1=CC=C(C=C1)CS(=O)(=O)N

Isomeric SMILES

CSCCC(C(=O)O)N.C1=CC=C(C=C1)CS(=O)(=O)N

InChI

InChI=1S/C7H9NO2S.C5H11NO2S/c8-11(9,10)6-7-4-2-1-3-5-7;1-9-3-2-4(6)5(7)8/h1-5H,6H2,(H2,8,9,10);4H,2-3,6H2,1H3,(H,7,8)