Vitas-M small molecule compound
methyl N-{[1-(4-fluorophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]carbonyl}alaninate
Catalog ID
STL159081
SMILES COC(=O)C(NC(=O)c1cnn(c1n1cccc1)c1ccc(cc1)F)C
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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 C18H17FN4O3 MW 356.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17FN4O3/c1-12(18(25)26-2)21-16(24)15-11-20-23(14-7-5-13(19)6-8-14)17(15)22-9-3-4-10-22/h3-12H,1-2H3,(H,21,24)InChIKey
LPOZACQEIYBCQE-UHFFFAOYSA-NSynonyms
(S)methyl2(1(4fluorophenyl)5(1Hpyrrol1yl)1Hpyrazole4carboxamido)propanoate
CC(C(=O)OC)NC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)F)N3C=CC=C3
COC(=O)(C@@H)(NC(=O)c1cnn(c1n1cccc1)c1ccc(cc1)F)C
InChI=1SC18H17FN4O3c112(18(25)262)2116(24)15112023(147513(19)6814)17(15)229341022h312H12H3(H2124)
methyl2((1(4fluorophenyl)5pyrrol1ylpyrazole4carbonyl)amino)propanoate
methylN((1(4fluorophenyl)5(1Hpyrrol1yl)1Hpyrazol4yl)carbonyl)alaninate
MFCD20758576
ZINC000049547556
ZINC000071333891
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