Vitas-M small molecule compound
1-benzyl-3-methyl-4-[4-(prop-2-en-1-yloxy)phenyl]-4,6,7,8-tetrahydrochromeno[2,3-c]pyrazol-5(1H)-one
Catalog ID
STK334099
SMILES C=CCOc1ccc(cc1)C1C2=C(CCCC2=O)Oc2c1c(C)nn2Cc1ccccc1
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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 C27H26N2O3 MW 426.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O3/c1-3-16-31-21-14-12-20(13-15-21)25-24-18(2)28-29(17-19-8-5-4-6-9-19)27(24)32-23-11-7-10-22(30)26(23)25/h3-6,8-9,12-15,25H,1,7,10-11,16-17H2,2H3InChIKey
VVZJJOOVIGABQJ-UHFFFAOYSA-NSynonyms
1benzyl3methyl4(4(prop2en1yloxy)phenyl)4678tetrahydrochromeno(23c)pyrazol5(1H)one
1benzyl3methyl4(4prop2enoxyphenyl)4678tetrahydrochromeno(23c)pyrazol5one
CC1=NN(C2=C1C(C3=C(O2)CCCC3=O)C4=CC=C(C=C4)OCC=C)CC5=CC=CC=C5
InChI=1SC27H26N2O3c13163121141220(131521)252418(2)2829(17198546919)27(24)32231171022(30)26(23)25h3689121525H1710111617H22H3
MFCD09963448
ZINC000018196904
ZINC000018196906
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