Vitas-M small molecule compound
2-(2-methyl-6-oxopyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-7(6H)-yl)-N-[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]acetamide
Catalog ID
STL539497
SMILES O=C(Cn1ccc2c(c1=O)cnc1n2nc(n1)C)NC[C@@H]1CCCN2[C@@H]1CCCC2
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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 C21H27N7O2 MW 409.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N7O2/c1-14-24-21-23-12-16-18(28(21)25-14)7-10-27(20(16)30)13-19(29)22-11-15-5-4-9-26-8-3-2-6-17(15)26/h7,10,12,15,17H,2-6,8-9,11,13H2,1H3,(H,22,29)/t15-,17+/m0/s1InChIKey
VXGXENJFBDPUSY-DOTOQJQBSA-NSynonyms
1435991-54-0~(N)(((1~(S)9~(a)~(R))23467899~(a)octahydro1~(H)quinolizin1yl)methyl)2(4methyl10oxo235711pentazatricyclo(7400^(26))trideca1(9)35712pentaen11yl)acetamide
1435991540
2(2methyl6oxopyrido(34e)(124)triazolo(15a)pyrimidin7(6H)yl)N(((1S9aR)octahydro1Hquinolizin1yl)methyl)acetamide
2(2methyl6oxopyrido(34e)(124)triazolo(15a)pyrimidin7(6H)yl)N((1S9aR)octahydro2Hquinolizin1ylmethyl)acetamide
71754606
InChI=1SC21H27N7O2c114242123121618(28(21)2514)71027(20(16)30)1319(29)22111554926832617(15)26h710121517H26891113H21H3(H2229)t1517+m0s1
O=C(Cn1ccc2c(c1=O)cnc1n2nc(n1)C)NC(C@@H)1CCCN2(C@@H)1CCCC2
ZINC000085875844
ZINC85875844
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