Vitas-M small molecule compound
tert-butyl 4-(2-{[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]amino}-2-oxoethyl)-4-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)piperidine-1-carboxylate
Catalog ID
STL590160
SMILES CSCC[C@@H](c1nc2c([nH]1)cccc2)NC(=O)CC1(CCN(CC1)C(=O)OC(C)(C)C)c1oc(C)cc(=O)c1O
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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 C29H38N4O6S MW 570.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H38N4O6S/c1-18-16-22(34)24(36)25(38-18)29(11-13-33(14-12-29)27(37)39-28(2,3)4)17-23(35)30-21(10-15-40-5)26-31-19-8-6-7-9-20(19)32-26/h6-9,16,21,36H,10-15,17H2,1-5H3,(H,30,35)(H,31,32)/t21-/m0/s1InChIKey
MWJZWXSSBDIRIW-NRFANRHFSA-NSynonyms
(S)tertbutyl4(2((1(1Hbenzo(d)imidazol2yl)3(methylthio)propyl)amino)2oxoethyl)4(3hydroxy6methyl4oxo4Hpyran2yl)piperidine1carboxylate
CSCC(C@@H)(c1nc2c((nH)1)cccc2)NC(=O)CC1(CCN(CC1)C(=O)OC(C)(C)C)c1oc(C)cc(=O)c1O
InChI=1SC29H38N4O6Sc1181622(34)24(36)25(3818)29(111333(141229)27(37)3928(23)4)1723(35)3021(1015405)263119867920(19)3226h69162136H101517H215H3(H3035)(H3132)t21m0s1
tertbutyl4(2(((1S)1(1Hbenzimidazol2yl)3(methylsulfanyl)propyl)amino)2oxoethyl)4(3hydroxy6methyl4oxo4Hpyran2yl)piperidine1carboxylate
Check stock
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Check stock on Vitas-MAvailable files
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