Analyte Name

[3aS-(3aalpha,4beta,6aalpha)]-Hexahydro-2-oxo-1,3-bis(phenylmethyl)-1H-Thieno[3,4-d]imidazole-4-pentanoic Acid Phenylmethyl Ester

CAS Number

179532-60-6

Molecular Formula

C31H34N2O3S

Molecular Weight

514.68

Accurate Mass

514.229

SMILES

O=C(CCCC[C@@H]1SC[C@H]2[C@@H]1N(Cc3ccccc3)C(=O)N2Cc4ccccc4)OCc5ccccc5

InChI

InChI=1S/C31H34N2O3S/c34-29(36-22-26-16-8-3-9-17-26)19-11-10-18-28-30-27(23-37-28)32(20-24-12-4-1-5-13-24)31(35)33(30)21-25-14-6-2-7-15-25/h1-9,12-17,27-28,30H,10-11,18-23H2/t27-,28-,30-/m0/s1

IUPAC

benzyl 5-[(3aS,4S,6aR)-1,3-dibenzyl-2-oxo-3a,4,6,6a-tetrahydrothieno[3,4-d]imidazol-4-yl]pentanoate

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat