Vitas-M small molecule compound
3-(2-butoxyphenyl)-N-(3-chlorobenzyl)-1H-pyrazole-5-carboxamide
Catalog ID
STL189396
SMILES CCCCOc1ccccc1c1n[nH]c(c1)C(=O)NCc1cccc(c1)Cl
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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 C21H22ClN3O2 MW 383.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClN3O2/c1-2-3-11-27-20-10-5-4-9-17(20)18-13-19(25-24-18)21(26)23-14-15-7-6-8-16(22)12-15/h4-10,12-13H,2-3,11,14H2,1H3,(H,23,26)(H,24,25)InChIKey
ITHRAMVDQWWGSI-UHFFFAOYSA-NSynonyms
3(2butoxyphenyl)N((3chlorophenyl)methyl)1Hpyrazole5carboxamide
3(2butoxyphenyl)N(3chlorobenzyl)1Hpyrazole5carboxamide
CCCCOC1=CC=CC=C1C2=NNC(=C2)C(=O)NCC3=CC(=CC=C3)Cl
CCCCOc1ccccc1c1n(nH)c(c1)C(=O)NCc1cccc(c1)Cl
InChI=1SC21H22ClN3O2c1231127201054917(20)181319(252418)21(26)23141576816(22)1215h4101213H231114H21H3(H2326)(H2425)
MFCD22389161
ZINC000072331593
ZINC72331593
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