4-[[4-[(3-cyclohexyl-2-cyclohexylimino-4-oxidanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-ethoxy-6-prop-2-enyl-phenoxy]methyl]benzoic acid

Systemtic Name: 4-[[4-[(3-cyclohexyl-2-cyclohexylimino-4-oxidanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-ethoxy-6-prop-2-enyl-phenoxy]methyl]benzoic acid Openeye Name: 4-[[2-allyl-4-[(3-cyclohexyl-2-cyclohexylimino-4-oxo-thiazolidin-5-ylidene)methyl]-6-ethoxy-phenoxy]methyl]benzoic acid CAS Name: 4-[[4-[(3-cyclohexyl-2-cyclohexylimino-4-oxo-5-thiazolidinylidene)methyl]-2-ethoxy-6-prop-2-enylphenoxy]methyl]benzoic acid IUPAC Name: 4-[[4-[(3-cyclohexyl-2-cyclohexylimino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]-2-ethoxy-6-prop-2-enylphenoxy]methyl]benzoic acid Traditional Name: 4-[[2-allyl-4-[(3-cyclohexyl-2-cyclohexylimino-4-keto-thiazolidin-5-ylidene)methyl]-6-ethoxy-phenoxy]methyl]benzoic acid Formula: C35H42N2O5S MolecularWeight: 602.78338

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC2=CC=C(C=C2)C(=O)O)CC=C)C=C3C(=O)N(C(=NC4CCCCC4)S3)C5CCCCC5

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC2=CC=C(C=C2)C(=O)O)CC=C)C=C3C(=O)N(C(=NC4CCCCC4)S3)C5CCCCC5

InChI

InChI=1S/C35H42N2O5S/c1-3-11-27-20-25(21-30(41-4-2)32(27)42-23-24-16-18-26(19-17-24)34(39)40)22-31-33(38)37(29-14-9-6-10-15-29)35(43-31)36-28-12-7-5-8-13-28/h3,16-22,28-29H,1,4-15,23H2,2H3,(H,39,40)