Vitas-M small molecule compound
4-[({[3-(3-methoxyphenyl)-6-oxopyridazin-1(6H)-yl]acetyl}amino)methyl]cyclohexanecarboxylic acid
Catalog ID
STL158684
SMILES COc1cccc(c1)c1ccc(=O)n(n1)CC(=O)NCC1CCC(CC1)C(=O)O
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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 C21H25N3O5 MW 399.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O5/c1-29-17-4-2-3-16(11-17)18-9-10-20(26)24(23-18)13-19(25)22-12-14-5-7-15(8-6-14)21(27)28/h2-4,9-11,14-15H,5-8,12-13H2,1H3,(H,22,25)(H,27,28)InChIKey
IHZVLNPERQIJQC-UHFFFAOYSA-NSynonyms
1246075-83-1(1r4r)4((2(3(3methoxyphenyl)6oxopyridazin1(6H)yl)acetamido)methyl)cyclohexanecarboxylicacid
1246075831
4((((3(3methoxyphenyl)6oxopyridazin1(6H)yl)acetyl)amino)methyl)cyclohexanecarboxylicacid
4(((2(3(3methoxyphenyl)6oxopyridazin1yl)acetyl)amino)methyl)cyclohexane1carboxylicacid
COC1=CC=CC(=C1)C2=NN(C(=O)C=C2)CC(=O)NCC3CCC(CC3)C(=O)O
COc1cccc(c1)c1ccc(=O)n(n1)CC(=O)NC(C@@H)1CC(C@H)(CC1)C(=O)O
InChI=1SC21H25N3O5c1291742316(1117)1891020(26)24(2318)1319(25)2212145715(8614)21(27)28h249111415H581213H21H3(H2225)(H2728)
MFCD20503808
ZINC000049545740
ZINC101678133
ZINC49545740
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