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1,3-Diéthyl ester 2-[3-[(3aS,4S,6aR)-hexahydro-2-oxo-1,3-bis(phénylméthyl)-1H-thiéno[3,4-d]imidazol-4-yl]propyl] acide propanedioïque, TRC
Spécification
Spécification
| Nom chimique ou matériau | Diethyl 4-[(3aS,4S,6aR)-1,3-Dibenzyl-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]butane-1,1-dicarboxylate |
| CAS | 101469-35-6 |
| Formule moléculaire | C29 H36 N2 O5 S |
| Quantité | 5 mg |
| Synonyme | Propanedioic acid, 2-[3-[(3aS,4S,6aR)-hexahydro-2-oxo-1,3-bis(phenylmethyl)-1H-thieno[3,4-d]imidazol-4-yl]propyl]-, 1,3-diethyl ester, Propanedioic acid, [3-[(3aS,4S,6aR)-hexahydro-2-oxo-1,3-bis(phenylmethyl)-1H-thieno[3,4-d]imidazol-4-yl]propyl]-, diethyl ester (9CI), Propanedioic acid, [3-[hexahydro-2-oxo-1,3-bis(phenylmethyl)-1H-thieno[3,4-d]imidazol-4-yl]propyl]-, diethyl ester, [3aS-(3aα,4β,6aα)]-, 1H-Thieno[3,4-d]imidazole, propanedioic acid deriv., Diethyl 4-[(3aS,4S,6aR)-1,3-Dibenzyl-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]butane-1,1-dicarboxylate |
| Formule InChI | InChI=1S/C29H36N2O5S/c1-3-35-27(32)23(28(33)36-4-2)16-11-17-25-26-24(20-37-25)30(18-21-12-7-5-8-13-21)29(34)31(26)19-22-14-9-6-10-15-22/h5-10,12-15,23-26H,3-4,11,16-20H2,1-2H3/t24-,25-,26-/m0/s1 |
| SMILES | CCOC(=O)C(CCC[C@@H]1SC[C@H]2[C@@H]1N(Cc3ccccc3)C(=O)N2Cc4ccccc4)C(=O)OCC |
| Nom IUPAC | 2-[3-[3aS,4S,6aR)-1,3-dibenzyl-2-oxo-3a,4,6,6a-tétrahydrothiéno[3,4-d]imidazol-4-yl]propyl]propanedioate |
| Poids moléculaire (g/mol) | 524.672 |
| Poids de la formule | 524.234 |
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