Vitas-M small molecule compound
methyl 2-{3-[(2,4-difluorophenoxy)methyl]phenyl}-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Catalog ID
STL178414
SMILES COC(=O)c1sc2c(c1C)c1nc(nn1cn2)c1cccc(c1)COc1ccc(cc1F)F
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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 C23H16F2N4O3S MW 466.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16F2N4O3S/c1-12-18-21-27-20(28-29(21)11-26-22(18)33-19(12)23(30)31-2)14-5-3-4-13(8-14)10-32-17-7-6-15(24)9-16(17)25/h3-9,11H,10H2,1-2H3InChIKey
XVCKWBWNGIRCRM-UHFFFAOYSA-NSynonyms
832127-11-4832127114
CC1=C(SC2=C1C3=NC(=NN3C=N2)C4=CC(=CC=C4)COC5=C(C=C(C=C5)F)F)C(=O)OC
InChI=1SC23H16F2N4O3Sc11218212720(2829(21)112622(18)3319(12)23(30)312)1453413(814)1032177615(24)916(17)25h3911H10H212H3
methyl2(3((24difluorophenoxy)methyl)phenyl)9methylthieno(32e)(124)triazolo(15c)pyrimidine8carboxylate
MFCD04135393
ZINC000002804803
ZINC02804803
ZINC2804803
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