Vitas-M small molecule compound
methyl N-{[3-(2-chlorophenyl)-6-oxopyridazin-1(6H)-yl]acetyl}valinate
Catalog ID
STL421585
SMILES COC(=O)C(C(C)C)NC(=O)Cn1nc(ccc1=O)c1ccccc1Cl
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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 C18H20ClN3O4 MW 377.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20ClN3O4/c1-11(2)17(18(25)26-3)20-15(23)10-22-16(24)9-8-14(21-22)12-6-4-5-7-13(12)19/h4-9,11,17H,10H2,1-3H3,(H,20,23)InChIKey
XHKPFAKMWPULQY-UHFFFAOYSA-NSynonyms
(S)methyl2(2(3(2chlorophenyl)6oxopyridazin1(6H)yl)acetamido)3methylbutanoate
CC(C)C(C(=O)OC)NC(=O)CN1C(=O)C=CC(=N1)C2=CC=CC=C2Cl
COC(=O)(C@H)(C(C)C)NC(=O)Cn1nc(ccc1=O)c1ccccc1Cl
InChI=1SC18H20ClN3O4c111(2)17(18(25)263)2015(23)102216(24)9814(2122)12645713(12)19h491117H10H213H3(H2023)
methyl2((2(3(2chlorophenyl)6oxopyridazin1yl)acetyl)amino)3methylbutanoate
methylN((3(2chlorophenyl)6oxopyridazin1(6H)yl)acetyl)valinate
MFCD30707620
ZINC000170625459
ZINC000252570808
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