Vitas-M small molecule compound
12-(3,4-dimethoxyphenyl)-2-[(2,6-dimethylphenoxy)methyl]-9,9-dimethyl-8,9,10,12-tetrahydro-11H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-11-one
Catalog ID
STK270863
SMILES COc1ccc(cc1OC)C1C2=C(Oc3c1c1nc(nn1cn3)COc1c(C)cccc1C)CC(CC2=O)(C)C
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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 C31H32N4O5 MW 540.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H32N4O5/c1-17-8-7-9-18(2)28(17)39-15-24-33-29-27-25(19-10-11-21(37-5)22(12-19)38-6)26-20(36)13-31(3,4)14-23(26)40-30(27)32-16-35(29)34-24/h7-12,16,25H,13-15H2,1-6H3InChIKey
VTCIDJJOCVLGAZ-UHFFFAOYSA-NSynonyms
845667-00-712(34dimethoxyphenyl)2((26dimethylphenoxy)methyl)99dimethyl891012tetrahydro11Hchromeno(32e)(124)triazolo(15c)pyrimidin11one
12(34dimethoxyphenyl)2((26dimethylphenoxy)methyl)99dimethyl910dihydro8Hchromeno(32e)(124)triazolo(15c)pyrimidin11(12H)one
845667007
CC1=C(C(=CC=C1)C)OCC2=NN3C=NC4=C(C3=N2)C(C5=C(O4)CC(CC5=O)(C)C)C6=CC(=C(C=C6)OC)OC
InChI=1SC31H32N4O5c11787918(2)28(17)39152433292725(19101121(375)22(1219)386)2620(36)1331(34)1423(26)4030(27)321635(29)3424h7121625H1315H216H3
MFCD04169105
ZINC000002416742
ZINC000002416743
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