Vitas-M small molecule compound
methyl N-{[3-(3-chlorophenyl)-1-methyl-1H-pyrazol-5-yl]carbonyl}phenylalaninate
Catalog ID
STL424942
SMILES COC(=O)C(NC(=O)c1cc(nn1C)c1cccc(c1)Cl)Cc1ccccc1
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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 C21H20ClN3O3 MW 397.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClN3O3/c1-25-19(13-17(24-25)15-9-6-10-16(22)12-15)20(26)23-18(21(27)28-2)11-14-7-4-3-5-8-14/h3-10,12-13,18H,11H2,1-2H3,(H,23,26)InChIKey
CXIJVWGCUVAEIY-UHFFFAOYSA-NSynonyms
(S)methyl2(3(3chlorophenyl)1methyl1Hpyrazole5carboxamido)3phenylpropanoate
CN1C(=CC(=N1)C2=CC(=CC=C2)Cl)C(=O)NC(CC3=CC=CC=C3)C(=O)OC
COC(=O)(C@@H)(NC(=O)c1cc(nn1C)c1cccc(c1)Cl)Cc1ccccc1
InChI=1SC21H20ClN3O3c12519(1317(2425)15961016(22)1215)20(26)2318(21(27)282)11147435814h310121318H11H212H3(H2326)
methyl2((5(3chlorophenyl)2methylpyrazole3carbonyl)amino)3phenylpropanoate
methylN((3(3chlorophenyl)1methyl1Hpyrazol5yl)carbonyl)phenylalaninate
MFCD30709667
ZINC000218162678
ZINC000252482071
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