Vitas-M small molecule compound

tert-butyl (2S)-2-{5-[(4-methylbenzyl)sulfanyl]-1,3,4-oxadiazol-2-yl}pyrrolidine-1-carboxylate

Catalog ID
STL564223
SMILES Cc1ccc(cc1)CSc1nnc(o1)[C@@H]1CCCN1C(=O)OC(C)(C)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C19H25N3O3S MW 375.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H25N3O3S/c1-13-7-9-14(10-8-13)12-26-17-21-20-16(24-17)15-6-5-11-22(15)18(23)25-19(2,3)4/h7-10,15H,5-6,11-12H2,1-4H3/t15-/m0/s1
InChIKey
HLOVLMHAANLYAV-HNNXBMFYSA-N
Synonyms
1173685-80-7
(S)2(5(4METHYLBENZYLSULFANYL)(134)OXADIAZOL2YL)PYRROLIDINE1CARBOXYLICACIDTERTBUTYLESTER
(S)tertbutyl2(5((4methylbenzyl)thio)134oxadiazol2yl)pyrrolidine1carboxylate
1173685807
7614593
Cc1ccc(cc1)CSc1nnc(o1)(C@@H)1CCCN1C(=O)OC(C)(C)C
InChI=1SC19H25N3O3Sc1137914(10813)122617212016(2417)15651122(15)18(23)2519(23)4h71015H561112H214H3t15m0s1
MFCD04031301
tertbutyl(2S)2(5((4methylbenzyl)sulfanyl)134oxadiazol2yl)pyrrolidine1carboxylate
TERTBUTYL(2S)2(5((4METHYLBENZYL)THIO)134OXADIAZOL2YL)PYRROLIDINE1CARBOXYLATE
tertbutyl(2S)2(5((4methylphenyl)methylsulfanyl)134oxadiazol2yl)pyrrolidine1carboxylate
TERTBUTYL(2S)2(5((4METHYLPHENYL)METHYLTHIO)(134OXADIAZOL2YL))PYRROLIDINECARBOXYLATE
ZINC000005298367

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.