Vitas-M small molecule compound
2-benzyl-12-(furan-2-yl)-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
STK598777
SMILES O=C1CC(C)(C)CC2=C1C(c1ccco1)c1c(O2)ncn2c1nc(n2)Cc1ccccc1
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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 C25H22N4O3 MW 426.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N4O3/c1-25(2)12-16(30)20-18(13-25)32-24-22(21(20)17-9-6-10-31-17)23-27-19(28-29(23)14-26-24)11-15-7-4-3-5-8-15/h3-10,14,21H,11-13H2,1-2H3InChIKey
DJICSGXYKBHMPN-UHFFFAOYSA-NSynonyms
879579-45-02benzyl12(furan2yl)99dimethyl891012tetrahydro11Hchromeno(32e)(124)triazolo(15c)pyrimidin11one
2benzyl12(furan2yl)99dimethyl910dihydro8Hchromeno(32e)(124)triazolo(15c)pyrimidin11(12H)one
879579450
CC1(CC2=C(C(C3=C(O2)N=CN4C3=NC(=N4)CC5=CC=CC=C5)C6=CC=CO6)C(=O)C1)C
InChI=1SC25H22N4O3c125(2)1216(30)2018(1325)322422(21(20)1796103117)232719(2829(23)142624)11157435815h3101421H1113H212H3
MFCD06794862
ZINC000009430248
ZINC000013576320
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