Vitas-M small molecule compound
tert-butyl (2S)-2-(5-{[(2,4-dihydroxy-6-methylpyrimidin-5-yl)methyl]sulfanyl}-1,3,4-oxadiazol-2-yl)pyrrolidine-1-carboxylate
Catalog ID
STL054364
SMILES Oc1nc(C)c(c(n1)O)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 C17H23N5O5S MW 409.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H23N5O5S/c1-9-10(12(23)19-14(24)18-9)8-28-15-21-20-13(26-15)11-6-5-7-22(11)16(25)27-17(2,3)4/h11H,5-8H2,1-4H3,(H2,18,19,23,24)/t11-/m0/s1InChIKey
GBLDXFGWDFLXFP-NSHDSACASA-NSynonyms
1173675-41-61173675416
CC1=C(C(=O)NC(=O)N1)CSC2=NN=C(O2)C3CCCN3C(=O)OC(C)(C)C
InChI=1SC17H23N5O5Sc1910(12(23)1914(24)189)82815212013(2615)1165722(11)16(25)2717(23)4h11H58H214H3(H218192324)t11m0s1
MFCD05738356
Oc1nc(C)c(c(n1)O)CSc1nnc(o1)(C@@H)1CCCN1C(=O)OC(C)(C)C
tertbutyl(2S)2(5(((24dihydroxy6methylpyrimidin5yl)methyl)sulfanyl)134oxadiazol2yl)pyrrolidine1carboxylate
tertbutyl(2S)2(5((6methyl24dioxo1Hpyrimidin5yl)methylsulfanyl)134oxadiazol2yl)pyrrolidine1carboxylate
ZINC000009499266
ZINC09499266
ZINC9499266
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