2-ethoxy-3-[4-[2-[2-[3-[4-[2-[4-(2-ethoxy-3-oxidanyl-3-oxidanylidene-propyl)phenyl]sulfanylethyl]-5-methyl-1,3-oxazol-2-yl]phenyl]-5-methyl-1,3-oxazol-4-yl]ethylsulfanyl]phenyl]propanoic acid

Systemtic Name: 2-ethoxy-3-[4-[2-[2-[3-[4-[2-[4-(2-ethoxy-3-oxidanyl-3-oxidanylidene-propyl)phenyl]sulfanylethyl]-5-methyl-1,3-oxazol-2-yl]phenyl]-5-methyl-1,3-oxazol-4-yl]ethylsulfanyl]phenyl]propanoic acid Openeye Name: 2-ethoxy-3-[4-[2-[2-[3-[4-[2-[4-(2-ethoxy-3-hydroxy-3-oxo-propyl)phenyl]sulfanylethyl]-5-methyl-oxazol-2-yl]phenyl]-5-methyl-oxazol-4-yl]ethylsulfanyl]phenyl]propanoic acid CAS Name: 2-ethoxy-3-[4-[2-[2-[3-[4-[2-[[4-(2-ethoxy-3-hydroxy-3-oxopropyl)phenyl]thio]ethyl]-5-methyl-2-oxazolyl]phenyl]-5-methyl-4-oxazolyl]ethylthio]phenyl]propanoic acid IUPAC Name: 2-ethoxy-3-[4-[2-[2-[3-[4-[2-[4-(2-ethoxy-3-hydroxy-3-oxopropyl)phenyl]sulfanylethyl]-5-methyl-1,3-oxazol-2-yl]phenyl]-5-methyl-1,3-oxazol-4-yl]ethylsulfanyl]phenyl]propanoic acid Traditional Name: 2-ethoxy-3-[4-[2-[2-[3-[4-[2-[[4-(2-ethoxy-3-hydroxy-3-keto-propyl)phenyl]thio]ethyl]-5-methyl-oxazol-2-yl]phenyl]-5-methyl-oxazol-4-yl]ethylthio]phenyl]propionic acid Formula: C40H44N2O8S2 MolecularWeight: 744.91596

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC=C(C=C1)SCCC2=C(OC(=N2)C3=CC(=CC=C3)C4=NC(=C(O4)C)CCSC5=CC=C(C=C5)CC(C(=O)O)OCC)C)C(=O)O

Isomeric SMILES

CCOC(CC1=CC=C(C=C1)SCCC2=C(OC(=N2)C3=CC(=CC=C3)C4=NC(=C(O4)C)CCSC5=CC=C(C=C5)CC(C(=O)O)OCC)C)C(=O)O

InChI

InChI=1S/C40H44N2O8S2/c1-5-47-35(39(43)44)22-27-10-14-31(15-11-27)51-20-18-33-25(3)49-37(41-33)29-8-7-9-30(24-29)38-42-34(26(4)50-38)19-21-52-32-16-12-28(13-17-32)23-36(40(45)46)48-6-2/h7-17,24,35-36H,5-6,18-23H2,1-4H3,(H,43,44)(H,45,46)