methyl 2-[[2-[(4-methoxyphenyl)methylsulfanyl]-2-methyl-propyl]amino]-3-sulfanyl-propanoate

Systemtic Name: methyl 2-[[2-[(4-methoxyphenyl)methylsulfanyl]-2-methyl-propyl]amino]-3-sulfanyl-propanoate Openeye Name: methyl 2-[[2-[(4-methoxyphenyl)methylsulfanyl]-2-methyl-propyl]amino]-3-sulfanyl-propanoate CAS Name: 3-mercapto-2-[[2-[(4-methoxyphenyl)methylthio]-2-methylpropyl]amino]propanoic acid methyl ester IUPAC Name: methyl 2-[[2-[(4-methoxyphenyl)methylsulfanyl]-2-methylpropyl]amino]-3-sulfanylpropanoate Traditional Name: 3-mercapto-2-[[2-methyl-2-(p-anisylthio)propyl]amino]propionic acid methyl ester Formula: C16H25NO3S2 MolecularWeight: 343.5046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(CS)C(=O)OC)SCC1=CC=C(C=C1)OC

Isomeric SMILES

CC(C)(CNC(CS)C(=O)OC)SCC1=CC=C(C=C1)OC

InChI

InChI=1S/C16H25NO3S2/c1-16(2,11-17-14(9-21)15(18)20-4)22-10-12-5-7-13(19-3)8-6-12/h5-8,14,17,21H,9-11H2,1-4H3