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

Systemtic Name: 4-[[3-cyclohexyl-2-(4-ethylphenyl)imino-4-oxidanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoic acid Openeye Name: 4-[[3-cyclohexyl-2-(4-ethylphenyl)imino-4-oxo-thiazolidin-5-ylidene]methyl]benzoic acid CAS Name: 4-[[3-cyclohexyl-2-(4-ethylphenyl)imino-4-oxo-5-thiazolidinylidene]methyl]benzoic acid IUPAC Name: 4-[[3-cyclohexyl-2-(4-ethylphenyl)imino-4-oxo-1,3-thiazolidin-5-ylidene]methyl]benzoic acid Traditional Name: 4-[[3-cyclohexyl-2-(4-ethylphenyl)imino-4-keto-thiazolidin-5-ylidene]methyl]benzoic acid Formula: C25H26N2O3S MolecularWeight: 434.55054

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N=C2N(C(=O)C(=CC3=CC=C(C=C3)C(=O)O)S2)C4CCCCC4

Isomeric SMILES

CCC1=CC=C(C=C1)N=C2N(C(=O)C(=CC3=CC=C(C=C3)C(=O)O)S2)C4CCCCC4

InChI

InChI=1S/C25H26N2O3S/c1-2-17-10-14-20(15-11-17)26-25-27(21-6-4-3-5-7-21)23(28)22(31-25)16-18-8-12-19(13-9-18)24(29)30/h8-16,21H,2-7H2,1H3,(H,29,30)