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

Systemtic Name: 2-[2-[(2R)-2-[(E)-5-cyclohexyl-4-oxidanyl-pent-1-enyl]-5-oxidanylidene-pyrrolidin-1-yl]ethylsulfanyl]-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[2-[(2R)-2-[(E)-5-cyclohexyl-4-hydroxy-pent-1-enyl]-5-oxo-pyrrolidin-1-yl]ethylsulfanyl]thiazole-4-carboxylic acid CAS Name: 2-[2-[(2R)-2-[(E)-5-cyclohexyl-4-hydroxypent-1-enyl]-5-oxo-1-pyrrolidinyl]ethylthio]-4-thiazolecarboxylic acid IUPAC Name: 2-[2-[(2R)-2-[(E)-5-cyclohexyl-4-hydroxypent-1-enyl]-5-oxopyrrolidin-1-yl]ethylsulfanyl]-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[2-[(2R)-2-[(E)-5-cyclohexyl-4-hydroxy-pent-1-enyl]-5-keto-pyrrolidino]ethylthio]thiazole-4-carboxylic acid Formula: C21H30N2O4S2 MolecularWeight: 438.6039

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(CC=CC2CCC(=O)N2CCSC3=NC(=CS3)C(=O)O)O

Isomeric SMILES

C1CCC(CC1)CC(C/C=C/[C@H]2CCC(=O)N2CCSC3=NC(=CS3)C(=O)O)O

InChI

InChI=1S/C21H30N2O4S2/c24-17(13-15-5-2-1-3-6-15)8-4-7-16-9-10-19(25)23(16)11-12-28-21-22-18(14-29-21)20(26)27/h4,7,14-17,24H,1-3,5-6,8-13H2,(H,26,27)/b7-4+/t16-,17?/m0/s1