Vitas-M small molecule compound
5-(4-nitrophenyl)-N-[3-(trifluoromethyl)benzyl]-1H-pyrazole-4-carboxamide
Catalog ID
STL184982
SMILES O=C(c1cn[nH]c1c1ccc(cc1)[N+](=O)[O-])NCc1cccc(c1)C(F)(F)F
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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 C18H13F3N4O3 MW 390.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13F3N4O3/c19-18(20,21)13-3-1-2-11(8-13)9-22-17(26)15-10-23-24-16(15)12-4-6-14(7-5-12)25(27)28/h1-8,10H,9H2,(H,22,26)(H,23,24)InChIKey
BOPJBZAGWPNNKH-UHFFFAOYSA-NSynonyms
5(4nitrophenyl)N((3(trifluoromethyl)phenyl)methyl)1Hpyrazole4carboxamide
5(4nitrophenyl)N(3(trifluoromethyl)benzyl)1Hpyrazole4carboxamide
C1=CC(=CC(=C1)C(F)(F)F)CNC(=O)C2=C(NN=C2)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC18H13F3N4O3c1918(2021)1331211(813)92217(26)1510232416(15)124614(7512)25(27)28h1810H9H2(H2226)(H2324)
MFCD22387124
O=C(c1cn(nH)c1c1ccc(cc1)(N+)(=O)(O))NCc1cccc(c1)C(F)(F)F
ZINC000072329397
ZINC72329397
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