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-(2,4-dimethoxyphenyl)acetamide
Catalog ID
STL074372
SMILES COc1cc(OC)ccc1NC(=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 C22H20ClN5O4 MW 453.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClN5O4/c1-13-4-5-14(23)8-18(13)28-21-16(10-25-28)22(30)27(12-24-21)11-20(29)26-17-7-6-15(31-2)9-19(17)32-3/h4-10,12H,11H2,1-3H3,(H,26,29)InChIKey
APFWZZZAKBMIGP-UHFFFAOYSA-NSynonyms
2(1(5chloro2methylphenyl)4oxo14dihydro5Hpyrazolo(34d)pyrimidin5yl)N(24dimethoxyphenyl)acetamide
2(1(5chloro2methylphenyl)4oxopyrazolo(34d)pyrimidin5yl)N(24dimethoxyphenyl)acetamide
CC1=C(C=C(C=C1)Cl)N2C3=C(C=N2)C(=O)N(C=N3)CC(=O)NC4=C(C=C(C=C4)OC)OC
InChI=1SC22H20ClN5O4c1134514(23)818(13)282116(102528)22(30)27(122421)1120(29)26177615(312)919(17)323h41012H11H213H3(H2629)
MFCD18195766
ZINC000057486462
ZINC57486462
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