Vitas-M small molecule compound
dimethyl 2-({[7-(difluoromethyl)-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)benzene-1,4-dicarboxylate
Catalog ID
STL394734
SMILES COC(=O)c1ccc(cc1NC(=O)c1cnn2c1nc(cc2C(F)F)c1ccc(cc1)C)C(=O)OC
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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 C25H20F2N4O5 MW 494.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20F2N4O5/c1-13-4-6-14(7-5-13)18-11-20(21(26)27)31-22(29-18)17(12-28-31)23(32)30-19-10-15(24(33)35-2)8-9-16(19)25(34)36-3/h4-12,21H,1-3H3,(H,30,32)InChIKey
FLESHCSILDTZDX-UHFFFAOYSA-NSynonyms
445230-02-4445230024
CC1=CC=C(C=C1)C2=NC3=C(C=NN3C(=C2)C(F)F)C(=O)NC4=C(C=CC(=C4)C(=O)OC)C(=O)OC
DIMETHYL2(((7(DIFLUOROMETHYL)5(4METHYLPHENYL)PYRAZOLO(15A)PYRIMIDIN3YL)CARBONYL)AMINO)BENZENE14DICARBOXYLATE
DIMETHYL2((7(DIFLUOROMETHYL)5(4METHYLPHENYL)PYRAZOLO(15A)PYRIMIDINE3CARBONYL)AMINO)BENZENE14DICARBOXYLATE
InChI=1SC25H20F2N4O5c1134614(7513)181120(21(26)27)3122(2918)17(122831)23(32)30191015(24(33)352)8916(19)25(34)363h41221H13H3(H3032)
MFCD02373419
ZINC000000649078
ZINC00649078
ZINC649078
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