Vitas-M small molecule compound

N-(3,5-dimethylphenyl)-6-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]hexanamide

Catalog ID
STK590431
SMILES O=C(Nc1cc(C)cc(c1)C)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

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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 C25H29N3O3 MW 419.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N3O3/c1-17-12-18(2)14-21(13-17)26-23(29)10-4-3-7-11-27-24(30)22-15-19-8-5-6-9-20(19)16-28(22)25(27)31/h5-6,8-9,12-14,22H,3-4,7,10-11,15-16H2,1-2H3,(H,26,29)/t22-/m0/s1
InChIKey
CNUPQVIRJQHOGT-QFIPXVFZSA-N
Synonyms
1173675-31-4
(S)N(35dimethylphenyl)6(13dioxo1010adihydroimidazo(15b)isoquinolin2(1H3H5H)yl)hexanamide
1173675314
6((10aS)13dioxo1010adihydro5Himidazo(15b)isoquinolin2yl)N(35dimethylphenyl)hexanamide
CC1=CC(=CC(=C1)NC(=O)CCCCCN2C(=O)C3CC4=CC=CC=C4CN3C2=O)C
InChI=1SC25H29N3O3c1171218(2)1421(1317)2623(29)10437112724(30)221519856920(19)1628(22)25(27)31h5689121422H34710111516H212H3(H2629)t22m0s1
MFCD07639255
N(35dimethylphenyl)6((10aS)13dioxo151010atetrahydroimidazo(15b)isoquinolin2(3H)yl)hexanamide
O=C(Nc1cc(C)cc(c1)C)CCCCCN1C(=O)(C@H)2N(C1=O)Cc1c(C2)cccc1
ZINC000005426259
ZINC05426259
ZINC5426259

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Available files

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