Vitas-M small molecule compound
7-(4-methoxyphenyl)-5-methyl-2-[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl][1,2,4]triazolo[4,3-c]pyrimidin-3(2H)-one
Catalog ID
STL103338
SMILES COc1ccc(cc1)c1cc2nn(c(=O)n2c(n1)C)CC(=O)N1CCOc2c1cc(C)cc2
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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 C24H23N5O4 MW 445.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N5O4/c1-15-4-9-21-20(12-15)27(10-11-33-21)23(30)14-28-24(31)29-16(2)25-19(13-22(29)26-28)17-5-7-18(32-3)8-6-17/h4-9,12-13H,10-11,14H2,1-3H3InChIKey
FKRJXSXIJGKTRZ-UHFFFAOYSA-NSynonyms
7(4methoxyphenyl)5methyl2(2(6methyl23dihydro14benzoxazin4yl)2oxoethyl)(124)triazolo(43c)pyrimidin3one
7(4methoxyphenyl)5methyl2(2(6methyl23dihydro4H14benzoxazin4yl)2oxoethyl)(124)triazolo(43c)pyrimidin3(2H)one
CC1=CC2=C(C=C1)OCCN2C(=O)CN3C(=O)N4C(=NC(=CC4=N3)C5=CC=C(C=C5)OC)C
InChI=1SC24H23N5O4c115492120(1215)27(10113321)23(30)142824(31)2916(2)2519(1322(29)2628)175718(323)8617h491213H101114H213H3
MFCD20734940
ZINC000067226579
ZINC67226579
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