(2R,3R)-2-[(4-methoxyphenyl)methylsulfanyl]-5-phenyl-3-(phenylmethoxycarbonylamino)pentanoic acid

Systemtic Name: (2R,3R)-2-[(4-methoxyphenyl)methylsulfanyl]-5-phenyl-3-(phenylmethoxycarbonylamino)pentanoic acid Openeye Name: (2R,3R)-3-(benzyloxycarbonylamino)-2-[(4-methoxyphenyl)methylsulfanyl]-5-phenyl-pentanoic acid CAS Name: (2R,3R)-2-[(4-methoxyphenyl)methylthio]-5-phenyl-3-(phenylmethoxycarbonylamino)pentanoic acid IUPAC Name: (2R,3R)-2-[(4-methoxyphenyl)methylsulfanyl]-5-phenyl-3-(phenylmethoxycarbonylamino)pentanoic acid Traditional Name: (2R,3R)-3-(benzyloxycarbonylamino)-2-(p-anisylthio)-5-phenyl-valeric acid Formula: C27H29NO5S MolecularWeight: 479.58786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CSC(C(CCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)CS[C@H]([C@@H](CCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C27H29NO5S/c1-32-23-15-12-22(13-16-23)19-34-25(26(29)30)24(17-14-20-8-4-2-5-9-20)28-27(31)33-18-21-10-6-3-7-11-21/h2-13,15-16,24-25H,14,17-19H2,1H3,(H,28,31)(H,29,30)/t24-,25-/m1/s1