Vitas-M small molecule compound
7-(difluoromethyl)-5-(4-methoxyphenyl)-N-(4-nitrophenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
Catalog ID
STL397959
SMILES COc1ccc(cc1)c1cc(C(F)F)n2c(n1)c(cn2)C(=O)Nc1ccc(cc1)[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 C21H15F2N5O4 MW 439.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15F2N5O4/c1-32-15-8-2-12(3-9-15)17-10-18(19(22)23)27-20(26-17)16(11-24-27)21(29)25-13-4-6-14(7-5-13)28(30)31/h2-11,19H,1H3,(H,25,29)InChIKey
RDGZCQLKHWMPKZ-UHFFFAOYSA-NSynonyms
445245-24-9445245249
7(DIFLUOROMETHYL)5(4METHOXYPHENYL)N(4NITROPHENYL)PYRAZOLO(15A)PYRIMIDINE3CARBOXAMIDE
7(DIFLUOROMETHYL)N(4NITROPHENYL)5(4METHOXYPHENYL)PYRAZOLO(15A)PYRIMIDINE3CARBOXAMIDE
COC1=CC=C(C=C1)C2=NC3=C(C=NN3C(=C2)C(F)F)C(=O)NC4=CC=C(C=C4)(N+)(=O)(O)
COc1ccc(cc1)c1cc(C(F)F)n2c(n1)c(cn2)C(=O)Nc1ccc(cc1)(N+)(=O)(O)
InChI=1SC21H15F2N5O4c132158212(3915)171018(19(22)23)2720(2617)16(112427)21(29)25134614(7513)28(30)31h21119H1H3(H2529)
MFCD02608318
ZINC000008454746
ZINC08454746
ZINC8454746
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