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methyl 3-azanyl-3-methyl-2-(phenylmethylsulfanyl)butanoate

methyl 3-azanyl-3-methyl-2-(phenylmethylsulfanyl)butanoate

Systemtic Name:methyl 3-azanyl-3-methyl-2-(phenylmethylsulfanyl)butanoate
Openeye Name:methyl 3-amino-2-benzylsulfanyl-3-methyl-butanoate
CAS Name:3-amino-3-methyl-2-(phenylmethylthio)butanoic acid methyl ester
IUPAC Name:methyl 3-amino-2-benzylsulfanyl-3-methylbutanoate
Traditional Name:3-amino-2-(benzylthio)-3-methyl-butyric acid methyl ester
Formula: C13H19NO2S
MolecularWeight: 253.36046
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C(=O)OC)SCC1=CC=CC=C1)N


Isomeric SMILES

CC(C)(C(C(=O)OC)SCC1=CC=CC=C1)N


InChI

InChI=1S/C13H19NO2S/c1-13(2,14)11(12(15)16-3)17-9-10-7-5-4-6-8-10/h4-8,11H,9,14H2,1-3H3


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