3-[[2-bromanyl-4-[(3-cyclohexyl-2-cyclohexylimino-4-oxidanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]methyl]benzoic acid

Systemtic Name: 3-[[2-bromanyl-4-[(3-cyclohexyl-2-cyclohexylimino-4-oxidanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]methyl]benzoic acid Openeye Name: 3-[[2-bromo-4-[(3-cyclohexyl-2-cyclohexylimino-4-oxo-thiazolidin-5-ylidene)methyl]phenoxy]methyl]benzoic acid CAS Name: 3-[[2-bromo-4-[(3-cyclohexyl-2-cyclohexylimino-4-oxo-5-thiazolidinylidene)methyl]phenoxy]methyl]benzoic acid IUPAC Name: 3-[[2-bromo-4-[(3-cyclohexyl-2-cyclohexylimino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy]methyl]benzoic acid Traditional Name: 3-[[2-bromo-4-[(3-cyclohexyl-2-cyclohexylimino-4-keto-thiazolidin-5-ylidene)methyl]phenoxy]methyl]benzoic acid Formula: C30H33BrN2O4S MolecularWeight: 597.56302

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N=C2N(C(=O)C(=CC3=CC(=C(C=C3)OCC4=CC=CC(=C4)C(=O)O)Br)S2)C5CCCCC5

Isomeric SMILES

C1CCC(CC1)N=C2N(C(=O)C(=CC3=CC(=C(C=C3)OCC4=CC=CC(=C4)C(=O)O)Br)S2)C5CCCCC5

InChI

InChI=1S/C30H33BrN2O4S/c31-25-17-20(14-15-26(25)37-19-21-8-7-9-22(16-21)29(35)36)18-27-28(34)33(24-12-5-2-6-13-24)30(38-27)32-23-10-3-1-4-11-23/h7-9,14-18,23-24H,1-6,10-13,19H2,(H,35,36)