Vitas-M small molecule compound
methyl N-{[3-(naphthalen-2-yl)-6-oxopyridazin-1(6H)-yl]acetyl}valinate
Catalog ID
STL155334
SMILES COC(=O)C(C(C)C)NC(=O)Cn1nc(ccc1=O)c1ccc2c(c1)cccc2
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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 C22H23N3O4 MW 393.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O4/c1-14(2)21(22(28)29-3)23-19(26)13-25-20(27)11-10-18(24-25)17-9-8-15-6-4-5-7-16(15)12-17/h4-12,14,21H,13H2,1-3H3,(H,23,26)InChIKey
HEKQXEDYYSEDKD-UHFFFAOYSA-NSynonyms
(S)methyl3methyl2(2(3(naphthalen2yl)6oxopyridazin1(6H)yl)acetamido)butanoate
CC(C)C(C(=O)OC)NC(=O)CN1C(=O)C=CC(=N1)C2=CC3=CC=CC=C3C=C2
COC(=O)(C@H)(C(C)C)NC(=O)Cn1nc(ccc1=O)c1ccc2c(c1)cccc2
InChI=1SC22H23N3O4c114(2)21(22(28)293)2319(26)132520(27)111018(2425)179815645716(15)1217h4121421H13H213H3(H2326)
methyl3methyl2((2(3naphthalen2yl6oxopyridazin1yl)acetyl)amino)butanoate
methylN((3(naphthalen2yl)6oxopyridazin1(6H)yl)acetyl)valinate
MFCD20757271
ZINC000049548714
ZINC000071328941
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