3-[(4-methylphenyl)methylsulfanyl]-2-[(2-methyl-3-sulfanyl-propanoyl)amino]propanoate

Systemtic Name: 3-[(4-methylphenyl)methylsulfanyl]-2-[(2-methyl-3-sulfanyl-propanoyl)amino]propanoate Openeye Name: 2-[(2-methyl-3-sulfanyl-propanoyl)amino]-3-(p-tolylmethylsulfanyl)propanoate CAS Name: 2-[(3-mercapto-2-methyl-1-oxopropyl)amino]-3-[(4-methylphenyl)methylthio]propanoate IUPAC Name: 3-[(4-methylphenyl)methylsulfanyl]-2-[(2-methyl-3-sulfanylpropanoyl)amino]propanoate Traditional Name: 2-[(3-mercapto-2-methyl-propanoyl)amino]-3-[(4-methylbenzyl)thio]propionate Formula: C15H20NO3S2- MolecularWeight: 326.4542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCC(C(=O)[O-])NC(=O)C(C)CS

Isomeric SMILES

CC1=CC=C(C=C1)CSCC(C(=O)[O-])NC(=O)C(C)CS

InChI

InChI=1S/C15H21NO3S2/c1-10-3-5-12(6-4-10)8-21-9-13(15(18)19)16-14(17)11(2)7-20/h3-6,11,13,20H,7-9H2,1-2H3,(H,16,17)(H,18,19)/p-1