Vitas-M small molecule compound
3-[(10aS)-7,8-dimethoxy-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-N-(3-methylbutyl)propanamide
Catalog ID
STL535115
SMILES COc1cc2CN3C(=O)N(C(=O)[C@@H]3Cc2cc1OC)CCC(=O)NCCC(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 C21H29N3O5 MW 403.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29N3O5/c1-13(2)5-7-22-19(25)6-8-23-20(26)16-9-14-10-17(28-3)18(29-4)11-15(14)12-24(16)21(23)27/h10-11,13,16H,5-9,12H2,1-4H3,(H,22,25)/t16-/m0/s1InChIKey
TXQPWLWAFMXYBB-INIZCTEOSA-NSynonyms
1014040-04-0(S)3(78dimethoxy13dioxo1010adihydroimidazo(15b)isoquinolin2(1H3H5H)yl)Nisopentylpropanamide
1014040040
17572066
3((10~(a)~(S))78dimethoxy13dioxo1010~(a)dihydro5~(H)imidazo(15b)isoquinolin2yl)~(N)(3methylbutyl)propanamide
3((10aS)78dimethoxy13dioxo151010atetrahydroimidazo(15b)isoquinolin2(3H)yl)N(3methylbutyl)propanamide
COc1cc2CN3C(=O)N(C(=O)(C@@H)3Cc2cc1OC)CCC(=O)NCCC(C)C
InChI=1SC21H29N3O5c113(2)572219(25)682320(26)169141017(283)18(294)1115(14)1224(16)21(23)27h10111316H5912H214H3(H2225)t16m0s1
ZINC000012901269
ZINC12901269
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