Vitas-M small molecule compound
3-(4-methylphenyl)-1-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol
Catalog ID
STL446632
SMILES Cc1ccc(cc1)C1=NN(C(C1)(O)C(F)(F)F)c1scc(n1)c1cccc(c1)[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 C20H15F3N4O3S MW 448.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15F3N4O3S/c1-12-5-7-13(8-6-12)16-10-19(28,20(21,22)23)26(25-16)18-24-17(11-31-18)14-3-2-4-15(9-14)27(29)30/h2-9,11,28H,10H2,1H3InChIKey
RZHYQKGVCWPFBM-UHFFFAOYSA-NSynonyms
3(4methylphenyl)1(4(3nitrophenyl)13thiazol2yl)5(trifluoromethyl)45dihydro1Hpyrazol5ol
5(4METHYLPHENYL)2(4(3NITROPHENYL)13THIAZOL2YL)3(TRIFLUOROMETHYL)4HPYRAZOL3OL
CC1=CC=C(C=C1)C2=NN(C(C2)(C(F)(F)F)O)C3=NC(=CS3)C4=CC(=CC=C4)(N+)(=O)(O)
Cc1ccc(cc1)C1=NN(C(C1)(O)C(F)(F)F)c1scc(n1)c1cccc(c1)(N+)(=O)(O)
InChI=1SC20H15F3N4O3Sc1125713(8612)161019(2820(2122)23)26(2516)182417(113118)1432415(914)27(29)30h291128H10H21H3
MFCD06241486
ZINC000008711538
ZINC000008711541
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