Vitas-M small molecule compound
7-(difluoromethyl)-N-[3-(4-ethoxyphenoxy)-5-nitrophenyl]-5-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide
Catalog ID
STL398297
SMILES CCOc1ccc(cc1)Oc1cc(cc(c1)[N+](=O)[O-])NC(=O)c1cnn2c1nc(cc2C(F)F)c1ccccc1
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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 C28H21F2N5O5 MW 545.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21F2N5O5/c1-2-39-20-8-10-21(11-9-20)40-22-13-18(12-19(14-22)35(37)38)32-28(36)23-16-31-34-25(26(29)30)15-24(33-27(23)34)17-6-4-3-5-7-17/h3-16,26H,2H2,1H3,(H,32,36)InChIKey
VGXHODWSTFQECK-UHFFFAOYSA-NSynonyms
445245-28-3445245283
7(DIFLUOROMETHYL)N(3(4ETHOXYPHENOXY)5NITROPHENYL)5PHENYLPYRAZOLO(15A)PYRIMIDINE3CARBOXAMIDE
CCOC1=CC=C(C=C1)OC2=CC(=CC(=C2)(N+)(=O)(O))NC(=O)C3=C4N=C(C=C(N4N=C3)C(F)F)C5=CC=CC=C5
CCOc1ccc(cc1)Oc1cc(cc(c1)(N+)(=O)(O))NC(=O)c1cnn2c1nc(cc2C(F)F)c1ccccc1
InChI=1SC28H21F2N5O5c12392081021(11920)40221318(1219(1422)35(37)38)3228(36)2316313425(26(29)30)1524(3327(23)34)176435717h31626H2H21H3(H3236)
MFCD02244115
ZINC000002110276
ZINC2110276
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