Vitas-M small molecule compound
4-[(10aS)-7,8-dimethoxy-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-N-(pyridin-4-ylmethyl)butanamide
Catalog ID
STK626245
SMILES COc1cc2CN3C(=O)N(C(=O)[C@@H]3Cc2cc1OC)CCCC(=O)NCc1ccncc1
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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 C23H26N4O5 MW 438.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4O5/c1-31-19-11-16-10-18-22(29)26(23(30)27(18)14-17(16)12-20(19)32-2)9-3-4-21(28)25-13-15-5-7-24-8-6-15/h5-8,11-12,18H,3-4,9-10,13-14H2,1-2H3,(H,25,28)/t18-/m0/s1InChIKey
BJCDIAXAVLFRJS-SFHVURJKSA-NSynonyms
1014412-11-3(S)4(78dimethoxy13dioxo1010adihydroimidazo(15b)isoquinolin2(1H3H5H)yl)N(pyridin4ylmethyl)butanamide
1014412113
4((10aS)78dimethoxy13dioxo1010adihydro5Himidazo(15b)isoquinolin2yl)N(pyridin4ylmethyl)butanamide
4((10aS)78dimethoxy13dioxo151010atetrahydroimidazo(15b)isoquinolin2(3H)yl)N(pyridin4ylmethyl)butanamide
COC1=C(C=C2CN3C(CC2=C1)C(=O)N(C3=O)CCCC(=O)NCC4=CC=NC=C4)OC
COc1cc2CN3C(=O)N(C(=O)(C@@H)3Cc2cc1OC)CCCC(=O)NCc1ccncc1
InChI=1SC23H26N4O5c131191116101822(29)26(23(30)27(18)1417(16)1220(19)322)93421(28)25131557248615h58111218H349101314H212H3(H2528)t18m0s1
MFCD09853671
ZINC000013692770
ZINC13692770
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