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2-[2-ethylsulfanylethyl-(4-methylphenyl)amino]propanoic acid

2-[2-ethylsulfanylethyl-(4-methylphenyl)amino]propanoic acid

Systemtic Name:2-[2-ethylsulfanylethyl-(4-methylphenyl)amino]propanoic acid
Openeye Name:2-[N-(2-ethylsulfanylethyl)-4-methyl-anilino]propanoic acid
CAS Name:2-[N-[2-(ethylthio)ethyl]-4-methylanilino]propanoic acid
IUPAC Name:2-[N-(2-ethylsulfanylethyl)-4-methylanilino]propanoic acid
Traditional Name:2-[N-[2-(ethylthio)ethyl]-4-methyl-anilino]propionic acid
Formula: C14H21NO2S
MolecularWeight: 267.38704
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Descriptors Computed from Structure

Canonical SMILES:

CCSCCN(C1=CC=C(C=C1)C)C(C)C(=O)O


Isomeric SMILES

CCSCCN(C1=CC=C(C=C1)C)C(C)C(=O)O


InChI

InChI=1S/C14H21NO2S/c1-4-18-10-9-15(12(3)14(16)17)13-7-5-11(2)6-8-13/h5-8,12H,4,9-10H2,1-3H3,(H,16,17)


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