Vitas-M small molecule compound
3-(3-chloro-4-fluorophenyl)-3-(3-hydroxy-5-methyl-1H-pyrazol-4-yl)propanamide
Catalog ID
STL424423
SMILES NC(=O)CC(c1c(C)[nH]nc1O)c1ccc(c(c1)Cl)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 C13H13ClFN3O2 MW 297.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13ClFN3O2/c1-6-12(13(20)18-17-6)8(5-11(16)19)7-2-3-10(15)9(14)4-7/h2-4,8H,5H2,1H3,(H2,16,19)(H2,17,18,20)InChIKey
ICYXEDLUGKZINI-UHFFFAOYSA-NSynonyms
1630851-34-11630851341
3(3chloro4fluorophenyl)3(3hydroxy5methyl1Hpyrazol4yl)propanamide
3(3chloro4fluorophenyl)3(3methyl5oxo12dihydropyrazol4yl)propanamide
CC1=C(C(=O)NN1)C(CC(=O)N)C2=CC(=C(C=C2)F)Cl
InChI=1SC13H13ClFN3O2c1612(13(20)18176)8(511(16)19)72310(15)9(14)47h248H5H21H3(H21619)(H2171820)
MFCD30709368
NC(=O)CC(c1c(C)(nH)nc1O)c1ccc(c(c1)Cl)F
ZINC000218367641
ZINC000218367697
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