(2S,3R)-2-azanyl-3-[(4-methylphenyl)methylsulfanyl]-3-phenyl-propanoic acid

Systemtic Name: (2S,3R)-2-azanyl-3-[(4-methylphenyl)methylsulfanyl]-3-phenyl-propanoic acid Openeye Name: (2S,3R)-2-amino-3-phenyl-3-(p-tolylmethylsulfanyl)propanoic acid CAS Name: (2S,3R)-2-amino-3-[(4-methylphenyl)methylthio]-3-phenylpropanoic acid IUPAC Name: (2S,3R)-2-amino-3-[(4-methylphenyl)methylsulfanyl]-3-phenylpropanoic acid Traditional Name: (2S,3R)-2-amino-3-[(4-methylbenzyl)thio]-3-phenyl-propionic acid Formula: C17H19NO2S MolecularWeight: 301.40326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC(C2=CC=CC=C2)C(C(=O)O)N

Isomeric SMILES

CC1=CC=C(C=C1)CS[C@H](C2=CC=CC=C2)[C@H](C(=O)O)N

InChI

InChI=1S/C17H19NO2S/c1-12-7-9-13(10-8-12)11-21-16(15(18)17(19)20)14-5-3-2-4-6-14/h2-10,15-16H,11,18H2,1H3,(H,19,20)/t15-,16-/m1/s1