Vitas-M small molecule compound
2-[(2,3-dimethylphenoxy)methyl]-12-(furan-2-yl)-8,9,10,12-tetrahydro-11H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-11-one
Catalog ID
STK571625
SMILES O=C1CCCC2=C1C(c1ccco1)c1c(O2)ncn2c1nc(n2)COc1cccc(c1C)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 C25H22N4O4 MW 442.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N4O4/c1-14-6-3-8-17(15(14)2)32-12-20-27-24-23-22(18-10-5-11-31-18)21-16(30)7-4-9-19(21)33-25(23)26-13-29(24)28-20/h3,5-6,8,10-11,13,22H,4,7,9,12H2,1-2H3InChIKey
FZERYFPKWPLMHG-UHFFFAOYSA-NSynonyms
902019-55-02((23dimethylphenoxy)methyl)12(furan2yl)891012tetrahydro11Hchromeno(32e)(124)triazolo(15c)pyrimidin11one
2((23dimethylphenoxy)methyl)12(furan2yl)910dihydro8Hchromeno(32e)(124)triazolo(15c)pyrimidin11(12H)one
902019550
CC1=C(C(=CC=C1)OCC2=NN3C=NC4=C(C3=N2)C(C5=C(O4)CCCC5=O)C6=CC=CO6)C
InChI=1SC25H22N4O4c11463817(15(14)2)32122027242322(18105113118)2116(30)74919(21)3325(23)261329(24)2820h356810111322H47912H212H3
MFCD06785759
ZINC000009252969
ZINC000013572591
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