Vitas-M small molecule compound
(3R)-N-{(2S)-1-[(1,3-benzodioxol-5-ylmethyl)amino]-3-methyl-1-oxobutan-2-yl}-2,2-dimethyl-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Catalog ID
STL529875
SMILES CC([C@@H](C(=O)NCc1ccc2c(c1)OCO2)NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)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 C26H29N3O5S MW 495.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O5S/c1-14(2)20(22(30)27-12-15-9-10-18-19(11-15)34-13-33-18)28-23(31)21-26(3,4)35-25-17-8-6-5-7-16(17)24(32)29(21)25/h5-11,14,20-21,25H,12-13H2,1-4H3,(H,27,30)(H,28,31)/t20-,21+,25?/m0/s1InChIKey
AFQIFXICWAUXAX-SXNCYPNXSA-NSynonyms
956991-48-3(3~(R))~(N)((2~(S))1(13benzodioxol5ylmethylamino)3methyl1oxobutan2yl)22dimethyl5oxo39~(b)dihydro(13)thiazolo(23a)isoindole3carboxamide
(3R)N((2S)1((13benzodioxol5ylmethyl)amino)3methyl1oxobutan2yl)22dimethyl5oxo2359btetrahydro(13)thiazolo(23a)isoindole3carboxamide
(3R)N((S)1((benzo(d)(13)dioxol5ylmethyl)amino)3methyl1oxobutan2yl)22dimethyl5oxo2359btetrahydrothiazolo(23a)isoindole3carboxamide
16405490
956991483
CC((C@@H)(C(=O)NCc1ccc2c(c1)OCO2)NC(=O)(C@H)1N2C(SC1(C)C)c1c(C2=O)cccc1)C
InChI=1SC26H29N3O5Sc114(2)20(22(30)2712159101819(1115)34133318)2823(31)2126(34)352517865716(17)24(32)29(21)25h51114202125H1213H214H3(H2730)(H2831)t2021+25?m0s1
ZINC000012888257
ZINC000012888263
Check stock
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