Vitas-M small molecule compound
1,3-dimethyl-4-nitro-N-[2-oxo-4-(trifluoromethyl)-2H-chromen-7-yl]-1H-pyrazole-5-carboxamide
Catalog ID
STK959781
SMILES O=c1oc2cc(ccc2c(c1)C(F)(F)F)NC(=O)c1n(C)nc(c1[N+](=O)[O-])C
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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 C16H11F3N4O5 MW 396.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11F3N4O5/c1-7-13(23(26)27)14(22(2)21-7)15(25)20-8-3-4-9-10(16(17,18)19)6-12(24)28-11(9)5-8/h3-6H,1-2H3,(H,20,25)InChIKey
IICDRWAXGPSNQF-UHFFFAOYSA-NSynonyms
514839-98-613dimethyl4nitroN(2oxo4(trifluoromethyl)2Hchromen7yl)1Hpyrazole5carboxamide
25DIMETHYL4NITRON(2OXO4(TRIFLUOROMETHYL)CHROMEN7YL)PYRAZOLE3CARBOXAMIDE
514839986
CC1=NN(C(=C1(N+)(=O)(O))C(=O)NC2=CC3=C(C=C2)C(=CC(=O)O3)C(F)(F)F)C
InChI=1SC16H11F3N4O5c1713(23(26)27)14(22(2)217)15(25)20834910(16(1718)19)612(24)2811(9)58h36H12H3(H2025)
MFCD02372598
O=c1oc2cc(ccc2c(c1)C(F)(F)F)NC(=O)c1n(C)nc(c1(N+)(=O)(O))C
ZINC000002486614
ZINC02486614
ZINC2486614
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