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

Systemtic Name: 4-[[4-[(3-cyclohexyl-2-cyclohexylimino-4-oxidanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]methyl]benzoic acid Openeye Name: 4-[[4-[(3-cyclohexyl-2-cyclohexylimino-4-oxo-thiazolidin-5-ylidene)methyl]phenoxy]methyl]benzoic acid CAS Name: 4-[[4-[(3-cyclohexyl-2-cyclohexylimino-4-oxo-5-thiazolidinylidene)methyl]phenoxy]methyl]benzoic acid IUPAC Name: 4-[[4-[(3-cyclohexyl-2-cyclohexylimino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy]methyl]benzoic acid Traditional Name: 4-[[4-[(3-cyclohexyl-2-cyclohexylimino-4-keto-thiazolidin-5-ylidene)methyl]phenoxy]methyl]benzoic acid Formula: C30H34N2O4S MolecularWeight: 518.66696

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H34N2O4S/c33-28-27(37-30(31-24-7-3-1-4-8-24)32(28)25-9-5-2-6-10-25)19-21-13-17-26(18-14-21)36-20-22-11-15-23(16-12-22)29(34)35/h11-19,24-25H,1-10,20H2,(H,34,35)