Vitas-M small molecule compound
1-(5-chloro-2-methylphenyl)-5-[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Catalog ID
STL074376
SMILES Cc1ccc2c(c1)N(CCO2)C(=O)Cn1cnc2c(c1=O)cnn2c1cc(Cl)ccc1C
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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 C23H20ClN5O3 MW 449.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20ClN5O3/c1-14-3-6-20-19(9-14)28(7-8-32-20)21(30)12-27-13-25-22-17(23(27)31)11-26-29(22)18-10-16(24)5-4-15(18)2/h3-6,9-11,13H,7-8,12H2,1-2H3InChIKey
ZLIRATYXWCUWHK-UHFFFAOYSA-NSynonyms
1(5chloro2methylphenyl)5(2(6methyl23dihydro14benzoxazin4yl)2oxoethyl)pyrazolo(34d)pyrimidin4one
1(5chloro2methylphenyl)5(2(6methyl23dihydro4H14benzoxazin4yl)2oxoethyl)15dihydro4Hpyrazolo(34d)pyrimidin4one
CC1=CC2=C(C=C1)OCCN2C(=O)CN3C=NC4=C(C3=O)C=NN4C5=C(C=CC(=C5)Cl)C
InChI=1SC23H20ClN5O3c114362019(914)28(783220)21(30)122713252217(23(27)31)112629(22)181016(24)5415(18)2h3691113H7812H212H3
MFCD18195770
ZINC000057486466
ZINC57486466
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