Vitas-M small molecule compound
1-(3-chloro-4-methylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Catalog ID
STK889688
SMILES Cc1ccc(cc1Cl)n1ncc2c1ncnc2Nc1ccc2c(c1)OCCO2
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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 C20H16ClN5O2 MW 393.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16ClN5O2/c1-12-2-4-14(9-16(12)21)26-20-15(10-24-26)19(22-11-23-20)25-13-3-5-17-18(8-13)28-7-6-27-17/h2-5,8-11H,6-7H2,1H3,(H,22,23,25)InChIKey
KWNUKXQAESJENF-UHFFFAOYSA-NSynonyms
1(3chloro4methylphenyl)N(23dihydro14benzodioxin6yl)1Hpyrazolo(34d)pyrimidin4amine
1(3chloro4methylphenyl)N(23dihydro14benzodioxin6yl)pyrazolo(34d)pyrimidin4amine
2H3HBENZO(34E)14DIOXIN6YL(1(3CHLORO4METHYLPHENYL)PYRAZOLO(45E)PYRIMIDIN4YL)AMINE
CC1=C(C=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NC4=CC5=C(C=C4)OCCO5)Cl
InChI=1SC20H16ClN5O2c1122414(916(12)21)262015(102426)19(22112320)2513351718(813)28762717h25811H67H21H3(H222325)
MFCD05956119
ZINC000008583975
ZINC08583975
ZINC8583975
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