Vitas-M small molecule compound
N-(3-chloro-4-fluorobenzyl)-2-[2-(3-fluorophenyl)-5-(2-hydroxyethyl)-4-methyl-6-oxopyrimidin-1(6H)-yl]acetamide
Catalog ID
STL110673
SMILES OCCc1c(C)nc(n(c1=O)CC(=O)NCc1ccc(c(c1)Cl)F)c1cccc(c1)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 C22H20ClF2N3O3 MW 447.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClF2N3O3/c1-13-17(7-8-29)22(31)28(21(27-13)15-3-2-4-16(24)10-15)12-20(30)26-11-14-5-6-19(25)18(23)9-14/h2-6,9-10,29H,7-8,11-12H2,1H3,(H,26,30)InChIKey
HSBRUKFLEYYHLD-UHFFFAOYSA-NSynonyms
CC1=C(C(=O)N(C(=N1)C2=CC(=CC=C2)F)CC(=O)NCC3=CC(=C(C=C3)F)Cl)CCO
InChI=1SC22H20ClF2N3O3c11317(7829)22(31)28(21(2713)1532416(24)1015)1220(30)2611145619(25)18(23)914h2691029H781112H21H3(H2630)
MFCD20745521
N((3chloro4fluorophenyl)methyl)2(2(3fluorophenyl)5(2hydroxyethyl)4methyl6oxopyrimidin1yl)acetamide
N(3chloro4fluorobenzyl)2(2(3fluorophenyl)5(2hydroxyethyl)4methyl6oxopyrimidin1(6H)yl)acetamide
ZINC000067316880
ZINC67316880
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