methyl (2S,3S)-3-[2-azanyl-5-(4-methoxyphenoxy)phenyl]sulfanyl-3-(4-methoxyphenyl)-2-oxidanyl-propanoate

Systemtic Name: methyl (2S,3S)-3-[2-azanyl-5-(4-methoxyphenoxy)phenyl]sulfanyl-3-(4-methoxyphenyl)-2-oxidanyl-propanoate Openeye Name: methyl (2S,3S)-3-[2-amino-5-(4-methoxyphenoxy)phenyl]sulfanyl-2-hydroxy-3-(4-methoxyphenyl)propanoate CAS Name: (2S,3S)-3-[[2-amino-5-(4-methoxyphenoxy)phenyl]thio]-2-hydroxy-3-(4-methoxyphenyl)propanoic acid methyl ester IUPAC Name: methyl (2S,3S)-3-[2-amino-5-(4-methoxyphenoxy)phenyl]sulfanyl-2-hydroxy-3-(4-methoxyphenyl)propanoate Traditional Name: (2S,3S)-3-[[2-amino-5-(4-methoxyphenoxy)phenyl]thio]-2-hydroxy-3-(4-methoxyphenyl)propionic acid methyl ester Formula: C24H25NO6S MolecularWeight: 455.5234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C(C(=O)OC)O)SC2=C(C=CC(=C2)OC3=CC=C(C=C3)OC)N

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H]([C@H](C(=O)OC)O)SC2=C(C=CC(=C2)OC3=CC=C(C=C3)OC)N

InChI

InChI=1S/C24H25NO6S/c1-28-16-6-4-15(5-7-16)23(22(26)24(27)30-3)32-21-14-19(12-13-20(21)25)31-18-10-8-17(29-2)9-11-18/h4-14,22-23,26H,25H2,1-3H3/t22-,23+/m1/s1