2-[2-[2-[(E)-5-cyclohexyl-4-methyl-4-oxidanyl-pent-1-enyl]-5-oxidanylidene-cyclopentyl]ethylsulfanyl]-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-[2-[2-[(E)-5-cyclohexyl-4-methyl-4-oxidanyl-pent-1-enyl]-5-oxidanylidene-cyclopentyl]ethylsulfanyl]-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[2-[2-[(E)-5-cyclohexyl-4-hydroxy-4-methyl-pent-1-enyl]-5-oxo-cyclopentyl]ethylsulfanyl]thiazole-4-carboxylic acid CAS Name: 2-[2-[2-[(E)-5-cyclohexyl-4-hydroxy-4-methylpent-1-enyl]-5-oxocyclopentyl]ethylthio]-4-thiazolecarboxylic acid IUPAC Name: 2-[2-[2-[(E)-5-cyclohexyl-4-hydroxy-4-methylpent-1-enyl]-5-oxocyclopentyl]ethylsulfanyl]-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[2-[2-[(E)-5-cyclohexyl-4-hydroxy-4-methyl-pent-1-enyl]-5-keto-cyclopentyl]ethylthio]thiazole-4-carboxylic acid Formula: C23H33NO4S2 MolecularWeight: 451.64242

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC=CC1CCC(=O)C1CCSC2=NC(=CS2)C(=O)O)(CC3CCCCC3)O

Isomeric SMILES

CC(C/C=C/C1CCC(=O)C1CCSC2=NC(=CS2)C(=O)O)(CC3CCCCC3)O

InChI

InChI=1S/C23H33NO4S2/c1-23(28,14-16-6-3-2-4-7-16)12-5-8-17-9-10-20(25)18(17)11-13-29-22-24-19(15-30-22)21(26)27/h5,8,15-18,28H,2-4,6-7,9-14H2,1H3,(H,26,27)/b8-5+