2-[4-[(4-methoxycarbonyl-1-oxidanylidene-1,3-thiazolidin-3-yl)sulfonyl]phenyl]-4-(4-pyrrolidin-1-ylphenyl)butanoic acid

Systemtic Name: 2-[4-[(4-methoxycarbonyl-1-oxidanylidene-1,3-thiazolidin-3-yl)sulfonyl]phenyl]-4-(4-pyrrolidin-1-ylphenyl)butanoic acid Openeye Name: 2-[4-[(4-methoxycarbonyl-1-oxo-1,3-thiazolidin-3-yl)sulfonyl]phenyl]-4-(4-pyrrolidin-1-ylphenyl)butanoic acid CAS Name: 2-[4-[(4-methoxycarbonyl-1-oxo-1,3-thiazolidin-3-yl)sulfonyl]phenyl]-4-[4-(1-pyrrolidinyl)phenyl]butanoic acid IUPAC Name: 2-[4-[(4-methoxycarbonyl-1-oxo-1,3-thiazolidin-3-yl)sulfonyl]phenyl]-4-(4-pyrrolidin-1-ylphenyl)butanoic acid Traditional Name: 2-[4-[(4-carbomethoxy-1-keto-1,3-thiazolidin-3-yl)sulfonyl]phenyl]-4-(4-pyrrolidinophenyl)butyric acid Formula: C25H30N2O7S2 MolecularWeight: 534.6449

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CS(=O)CN1S(=O)(=O)C2=CC=C(C=C2)C(CCC3=CC=C(C=C3)N4CCCC4)C(=O)O

Isomeric SMILES

COC(=O)C1CS(=O)CN1S(=O)(=O)C2=CC=C(C=C2)C(CCC3=CC=C(C=C3)N4CCCC4)C(=O)O

InChI

InChI=1S/C25H30N2O7S2/c1-34-25(30)23-16-35(31)17-27(23)36(32,33)21-11-7-19(8-12-21)22(24(28)29)13-6-18-4-9-20(10-5-18)26-14-2-3-15-26/h4-5,7-12,22-23H,2-3,6,13-17H2,1H3,(H,28,29)