2-[(2S,5S)-2-[4-[2-[4-[(2S,5S)-5-(carboxymethyl)-2-methyl-3-(4-methylphenyl)-4-oxidanylidene-1,3-thiazolidin-2-yl]phenyl]ethyl]phenyl]-2-methyl-3-(4-methylphenyl)-4-oxidanylidene-1,3-thiazolidin-5-yl]ethanoic acid

Systemtic Name: 2-[(2S,5S)-2-[4-[2-[4-[(2S,5S)-5-(carboxymethyl)-2-methyl-3-(4-methylphenyl)-4-oxidanylidene-1,3-thiazolidin-2-yl]phenyl]ethyl]phenyl]-2-methyl-3-(4-methylphenyl)-4-oxidanylidene-1,3-thiazolidin-5-yl]ethanoic acid Openeye Name: 2-[(2S,5S)-2-[4-[2-[4-[(2S,5S)-5-(carboxymethyl)-2-methyl-4-oxo-3-(p-tolyl)thiazolidin-2-yl]phenyl]ethyl]phenyl]-2-methyl-4-oxo-3-(p-tolyl)thiazolidin-5-yl]acetic acid CAS Name: 2-[(2S,5S)-2-[4-[2-[4-[(2S,5S)-5-(carboxymethyl)-2-methyl-3-(4-methylphenyl)-4-oxo-2-thiazolidinyl]phenyl]ethyl]phenyl]-2-methyl-3-(4-methylphenyl)-4-oxo-5-thiazolidinyl]acetic acid IUPAC Name: 2-[(2S,5S)-2-[4-[2-[4-[(2S,5S)-5-(carboxymethyl)-2-methyl-3-(4-methylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]ethyl]phenyl]-2-methyl-3-(4-methylphenyl)-4-oxo-1,3-thiazolidin-5-yl]acetic acid Traditional Name: 2-[(2S,5S)-2-[4-[2-[4-[(2S,5S)-5-(carboxymethyl)-4-keto-2-methyl-3-(p-tolyl)thiazolidin-2-yl]phenyl]ethyl]phenyl]-4-keto-2-methyl-3-(p-tolyl)thiazolidin-5-yl]acetic acid Formula: C40H40N2O6S2 MolecularWeight: 708.8854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C(SC2(C)C3=CC=C(C=C3)CCC4=CC=C(C=C4)C5(N(C(=O)C(S5)CC(=O)O)C6=CC=C(C=C6)C)C)CC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)[C@@H](S[C@@]2(C)C3=CC=C(C=C3)CCC4=CC=C(C=C4)[C@]5(N(C(=O)[C@@H](S5)CC(=O)O)C6=CC=C(C=C6)C)C)CC(=O)O

InChI

InChI=1S/C40H40N2O6S2/c1-25-5-19-31(20-6-25)41-37(47)33(23-35(43)44)49-39(41,3)29-15-11-27(12-16-29)9-10-28-13-17-30(18-14-28)40(4)42(32-21-7-26(2)8-22-32)38(48)34(50-40)24-36(45)46/h5-8,11-22,33-34H,9-10,23-24H2,1-4H3,(H,43,44)(H,45,46)/t33-,34-,39-,40-/m0/s1