Vitas-M small molecule compound
3-(2-butoxyphenyl)-N-(4-fluorobenzyl)-1H-pyrazole-5-carboxamide
Catalog ID
STL189393
SMILES CCCCOc1ccccc1c1n[nH]c(c1)C(=O)NCc1ccc(cc1)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 C21H22FN3O2 MW 367.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22FN3O2/c1-2-3-12-27-20-7-5-4-6-17(20)18-13-19(25-24-18)21(26)23-14-15-8-10-16(22)11-9-15/h4-11,13H,2-3,12,14H2,1H3,(H,23,26)(H,24,25)InChIKey
CMNAZNLRRLYNBY-UHFFFAOYSA-NSynonyms
3(2butoxyphenyl)N((4fluorophenyl)methyl)1Hpyrazole5carboxamide
3(2butoxyphenyl)N(4fluorobenzyl)1Hpyrazole5carboxamide
CCCCOC1=CC=CC=C1C2=NNC(=C2)C(=O)NCC3=CC=C(C=C3)F
CCCCOc1ccccc1c1n(nH)c(c1)C(=O)NCc1ccc(cc1)F
InChI=1SC21H22FN3O2c123122720754617(20)181319(252418)21(26)23141581016(22)11915h41113H231214H21H3(H2326)(H2425)
MFCD22389158
ZINC000071113097
ZINC71113097
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