Vitas-M small molecule compound
3-(4-butoxyphenyl)-N-(3-chlorobenzyl)-1H-pyrazole-5-carboxamide
Catalog ID
STL189362
SMILES CCCCOc1ccc(cc1)c1n[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/c1-2-3-11-27-18-9-7-16(8-10-18)19-13-20(25-24-19)21(26)23-14-15-5-4-6-17(22)12-15/h4-10,12-13H,2-3,11,14H2,1H3,(H,23,26)(H,24,25)InChIKey
BFAPAGULURQHGB-UHFFFAOYSA-NSynonyms
3(4butoxyphenyl)N((3chlorophenyl)methyl)1Hpyrazole5carboxamide
3(4butoxyphenyl)N(3chlorobenzyl)1Hpyrazole5carboxamide
CCCCOC1=CC=C(C=C1)C2=NNC(=C2)C(=O)NCC3=CC(=CC=C3)Cl
CCCCOc1ccc(cc1)c1n(nH)c(c1)C(=O)NCc1cccc(c1)Cl
InChI=1SC21H22ClN3O2c1231127189716(81018)191320(252419)21(26)23141554617(22)1215h4101213H231114H21H3(H2326)(H2425)
MFCD22389127
ZINC000072331560
ZINC72331560
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