Vitas-M small molecule compound

6-[(10aS)-7,8-dimethoxy-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-N-(pyridin-2-ylmethyl)hexanamide

Catalog ID
STK628580
SMILES COc1cc2CN3C(=O)N(C(=O)[C@@H]3Cc2cc1OC)CCCCCC(=O)NCc1ccccn1

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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 C25H30N4O5 MW 466.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N4O5/c1-33-21-13-17-12-20-24(31)28(25(32)29(20)16-18(17)14-22(21)34-2)11-7-3-4-9-23(30)27-15-19-8-5-6-10-26-19/h5-6,8,10,13-14,20H,3-4,7,9,11-12,15-16H2,1-2H3,(H,27,30)/t20-/m0/s1
InChIKey
MBRZUEYXMZDONI-FQEVSTJZSA-N
Synonyms
1014410-69-5
(S)6(78dimethoxy13dioxo1010adihydroimidazo(15b)isoquinolin2(1H3H5H)yl)N(pyridin2ylmethyl)hexanamide
1014410695
6((10aS)78dimethoxy13dioxo1010adihydro5Himidazo(15b)isoquinolin2yl)N(pyridin2ylmethyl)hexanamide
6((10aS)78dimethoxy13dioxo151010atetrahydroimidazo(15b)isoquinolin2(3H)yl)N(pyridin2ylmethyl)hexanamide
COC1=C(C=C2CN3C(CC2=C1)C(=O)N(C3=O)CCCCCC(=O)NCC4=CC=CC=N4)OC
COc1cc2CN3C(=O)N(C(=O)(C@@H)3Cc2cc1OC)CCCCCC(=O)NCc1ccccn1
InChI=1SC25H30N4O5c133211317122024(31)28(25(32)29(20)1618(17)1422(21)342)11734923(30)271519856102619h56810131420H347911121516H212H3(H2730)t20m0s1
MFCD09850685
ZINC000013688329
ZINC13688329

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Available files

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