Vitas-M small molecule compound
2,5-dioxopyrrolidin-1-yl N-{[(3R)-2,2-dimethyl-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindol-3-yl]carbonyl}-L-alaninate
Catalog ID
STK574891
SMILES O=C([C@@H](NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)C)ON1C(=O)CCC1=O
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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 C20H21N3O6S MW 431.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O6S/c1-10(19(28)29-23-13(24)8-9-14(23)25)21-16(26)15-20(2,3)30-18-12-7-5-4-6-11(12)17(27)22(15)18/h4-7,10,15,18H,8-9H2,1-3H3,(H,21,26)/t10-,15+,18?/m0/s1InChIKey
BCVGOHHCANHHST-UTEXHPTLSA-NSynonyms
1014043-67-4(25dioxopyrrolidin1yl)(2S)2(((3R)22dimethyl5oxo39bdihydro(13)thiazolo(23a)isoindole3carbonyl)amino)propanoate
(2S)25dioxopyrrolidin1yl2((3R)22dimethyl5oxo2359btetrahydrothiazolo(23a)isoindole3carboxamido)propanoate
1014043674
25dioxopyrrolidin1ylN(((3R)22dimethyl5oxo2359btetrahydro(13)thiazolo(23a)isoindol3yl)carbonyl)Lalaninate
CC(C(=O)ON1C(=O)CCC1=O)NC(=O)C2C(SC3N2C(=O)C4=CC=CC=C34)(C)C
InChI=1SC20H21N3O6Sc110(19(28)292313(24)8914(23)25)2116(26)1520(23)301812754611(12)17(27)22(15)18h47101518H89H213H3(H2126)t1015+18?m0s1
O=C((C@@H)(NC(=O)(C@H)1N2C(SC1(C)C)c1c(C2=O)cccc1)C)ON1C(=O)CCC1=O
ZINC000097957073
ZINC000097957074
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