Vitas-M small molecule compound
9,9-dimethyl-2-(phenoxymethyl)-12-phenyl-8,9,10,12-tetrahydro-11H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-11-one
Catalog ID
STK270390
SMILES O=C1CC(C)(C)CC2=C1C(c1ccccc1)c1c(O2)ncn2c1nc(n2)COc1ccccc1
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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 C27H24N4O3 MW 452.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24N4O3/c1-27(2)13-19(32)23-20(14-27)34-26-24(22(23)17-9-5-3-6-10-17)25-29-21(30-31(25)16-28-26)15-33-18-11-7-4-8-12-18/h3-12,16,22H,13-15H2,1-2H3InChIKey
ARCHQLMVWUGIEC-UHFFFAOYSA-NSynonyms
847855-57-6847855576
99dimethyl2(phenoxymethyl)12phenyl891012tetrahydro11Hchromeno(32e)(124)triazolo(15c)pyrimidin11one
99dimethyl2(phenoxymethyl)12phenyl910dihydro8Hchromeno(32e)(124)triazolo(15c)pyrimidin11(12H)one
CC1(CC2=C(C(C3=C(O2)N=CN4C3=NC(=N4)COC5=CC=CC=C5)C6=CC=CC=C6)C(=O)C1)C
InChI=1SC27H24N4O3c127(2)1319(32)2320(1427)342624(22(23)1795361017)252921(3031(25)162826)153318117481218h3121622H1315H212H3
MFCD04185222
ZINC000002408838
ZINC000002408839
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