Vitas-M small molecule compound
(3R)-2,2-dimethyl-N-{(2S)-4-methyl-1-[(3-methylbutyl)amino]-1-oxopentan-2-yl}-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Catalog ID
STL532935
SMILES CC(CCNC(=O)[C@@H](NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)CC(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 C24H35N3O3S MW 445.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H35N3O3S/c1-14(2)11-12-25-20(28)18(13-15(3)4)26-21(29)19-24(5,6)31-23-17-10-8-7-9-16(17)22(30)27(19)23/h7-10,14-15,18-19,23H,11-13H2,1-6H3,(H,25,28)(H,26,29)/t18-,19+,23?/m0/s1InChIKey
JJTCYRWWBGWERI-HXIJRHRVSA-NSynonyms
956817-78-0(3~(R))22dimethyl~(N)((2~(S))4methyl1(3methylbutylamino)1oxopentan2yl)5oxo39~(b)dihydro(13)thiazolo(23a)isoindole3carboxamide
(3R)22dimethylN((2S)4methyl1((3methylbutyl)amino)1oxopentan2yl)5oxo2359btetrahydro(13)thiazolo(23a)isoindole3carboxamide
(3R)N((S)1(isopentylamino)4methyl1oxopentan2yl)22dimethyl5oxo2359btetrahydrothiazolo(23a)isoindole3carboxamide
16406121
956817780
CC(CCNC(=O)(C@@H)(NC(=O)(C@H)1N2C(SC1(C)C)c1c(C2=O)cccc1)CC(C)C)C
InChI=1SC24H35N3O3Sc114(2)11122520(28)18(1315(3)4)2621(29)1924(56)3123171087916(17)22(30)27(19)23h7101415181923H1113H216H3(H2528)(H2629)t1819+23?m0s1
ZINC000008876331
ZINC000008876333
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