Vitas-M small molecule compound
N-{3,5-dimethyl-1-[3-(trifluoromethyl)benzyl]-1H-pyrazol-4-yl}-1,3-benzodioxole-5-carboxamide
Catalog ID
STK309259
SMILES O=C(c1ccc2c(c1)OCO2)Nc1c(C)nn(c1C)Cc1cccc(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 C21H18F3N3O3 MW 417.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18F3N3O3/c1-12-19(25-20(28)15-6-7-17-18(9-15)30-11-29-17)13(2)27(26-12)10-14-4-3-5-16(8-14)21(22,23)24/h3-9H,10-11H2,1-2H3,(H,25,28)InChIKey
AXLCGWZKTQGZQY-UHFFFAOYSA-NSynonyms
1005643-84-41005643844
CC1=C(C(=NN1CC2=CC(=CC=C2)C(F)(F)F)C)NC(=O)C3=CC4=C(C=C3)OCO4
InChI=1SC21H18F3N3O3c11219(2520(28)15671718(915)30112917)13(2)27(2612)101443516(814)21(2223)24h39H1011H212H3(H2528)
MFCD04052249
N(35DIMETHYL1((3(TRIFLUOROMETHYL)PHENYL)METHYL)PYRAZOL4YL)13BENZODIOXOLE5CARBOXAMIDE
N(35dimethyl1(3(trifluoromethyl)benzyl)1Hpyrazol4yl)13benzodioxole5carboxamide
ZINC000002800181
ZINC02800181
ZINC2800181
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