2-azanyl-3-[(4-tert-butylphenyl)-phenyl-methyl]sulfanyl-propanoic acid

Systemtic Name: 2-azanyl-3-[(4-tert-butylphenyl)-phenyl-methyl]sulfanyl-propanoic acid Openeye Name: 2-amino-3-[(4-tert-butylphenyl)-phenyl-methyl]sulfanyl-propanoic acid CAS Name: 2-amino-3-[[(4-tert-butylphenyl)-phenylmethyl]thio]propanoic acid IUPAC Name: 2-amino-3-[(4-tert-butylphenyl)-phenylmethyl]sulfanylpropanoic acid Traditional Name: 2-amino-3-[[(4-tert-butylphenyl)-phenyl-methyl]thio]propionic acid Formula: C20H25NO2S MolecularWeight: 343.483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(C2=CC=CC=C2)SCC(C(=O)O)N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(C2=CC=CC=C2)SCC(C(=O)O)N

InChI

InChI=1S/C20H25NO2S/c1-20(2,3)16-11-9-15(10-12-16)18(14-7-5-4-6-8-14)24-13-17(21)19(22)23/h4-12,17-18H,13,21H2,1-3H3,(H,22,23)