Vitas-M small molecule compound

ethyl 4-[(10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methyl]piperazine-1-carboxylate

Catalog ID
STK577334
SMILES CCOC(=O)N1CCN(CC1)Cc1nn2c(n1)c1c(nc2)sc2c1CC(C)(C)OC2

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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 C20H26N6O3S MW 430.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N6O3S/c1-4-28-19(27)25-7-5-24(6-8-25)10-15-22-17-16-13-9-20(2,3)29-11-14(13)30-18(16)21-12-26(17)23-15/h12H,4-11H2,1-3H3
InChIKey
XEQIOGCXSGPPIX-UHFFFAOYSA-N
Synonyms
895829-56-8
895829568
CCOC(=O)N1CCN(CC1)CC2=NN3C=NC4=C(C3=N2)C5=C(S4)COC(C5)(C)C
ethyl4((1010dimethyl1011dihydro8Hpyrano(4345)thieno(32e)(124)triazolo(15c)pyrimidin2yl)methyl)piperazine1carboxylate
InChI=1SC20H26N6O3Sc142819(27)257524(6825)101522171613920(23)291114(13)3018(16)211226(17)2315h12H411H213H3
MFCD06601454
ZINC000020518553
ZINC20518553

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.