Vitas-M small molecule compound
7-(difluoromethyl)-N-(2-methoxy-4-nitrophenyl)-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
Catalog ID
STL392866
SMILES COc1cc(ccc1NC(=O)c1cnn2c1nc(cc2C(F)F)c1ccc(cc1)C)[N+](=O)[O-]
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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 C22H17F2N5O4 MW 453.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17F2N5O4/c1-12-3-5-13(6-4-12)17-10-18(20(23)24)28-21(26-17)15(11-25-28)22(30)27-16-8-7-14(29(31)32)9-19(16)33-2/h3-11,20H,1-2H3,(H,27,30)InChIKey
YQXBUEPMXISBRB-UHFFFAOYSA-NSynonyms
515873-41-3515873413
7(DIFLUOROMETHYL)N(2METHOXY4NITROPHENYL)5(4METHYLPHENYL)PYRAZOLO(15A)PYRIMIDINE3CARBOXAMIDE
7(DIFLUOROMETHYL)N(4NITRO2METHOXYPHENYL)5(4METHYLPHENYL)PYRAZOLO(15A)PYRIMIDINE3CARBOXAMIDE
CC1=CC=C(C=C1)C2=NC3=C(C=NN3C(=C2)C(F)F)C(=O)NC4=C(C=C(C=C4)(N+)(=O)(O))OC
COc1cc(ccc1NC(=O)c1cnn2c1nc(cc2C(F)F)c1ccc(cc1)C)(N+)(=O)(O)
InChI=1SC22H17F2N5O4c1123513(6412)171018(20(23)24)2821(2617)15(112528)22(30)27168714(29(31)32)919(16)332h31120H12H3(H2730)
MFCD02374220
ZINC000008454737
ZINC08454737
ZINC8454737
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