Vitas-M small molecule compound
2-[1-(5-chloro-2-methylphenyl)-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]-N-(1,3-thiazol-2-yl)acetamide
Catalog ID
STL031304
SMILES O=C(Cn1cnc2c(c1=O)cnn2c1cc(Cl)ccc1C)Nc1nccs1
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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 C17H13ClN6O2S MW 400.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13ClN6O2S/c1-10-2-3-11(18)6-13(10)24-15-12(7-21-24)16(26)23(9-20-15)8-14(25)22-17-19-4-5-27-17/h2-7,9H,8H2,1H3,(H,19,22,25)InChIKey
SREGVLZBVPJOKW-UHFFFAOYSA-NSynonyms
2(1(5chloro2methylphenyl)4oxo14dihydro5Hpyrazolo(34d)pyrimidin5yl)N(13thiazol2yl)acetamide
2(1(5chloro2methylphenyl)4oxopyrazolo(34d)pyrimidin5yl)N(13thiazol2yl)acetamide
CC1=C(C=C(C=C1)Cl)N2C3=C(C=N2)C(=O)N(C=N3)CC(=O)NC4=NC=CS4
InChI=1SC17H13ClN6O2Sc1102311(18)613(10)241512(72124)16(26)23(92015)814(25)221719452717h279H8H21H3(H192225)
MFCD18191368
ZINC000057428346
ZINC57428346
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