Vitas-M small molecule compound
3-{10-[2-(4-methoxyphenoxy)ethyl]-4-oxo-4,10-dihydro[1,2,4]triazino[4,3-a]benzimidazol-3-yl}propanoic acid
Catalog ID
STK692851
SMILES COc1ccc(cc1)OCCn1c2nnc(c(=O)n2c2c1cccc2)CCC(=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 C21H20N4O5 MW 408.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O5/c1-29-14-6-8-15(9-7-14)30-13-12-24-17-4-2-3-5-18(17)25-20(28)16(10-11-19(26)27)22-23-21(24)25/h2-9H,10-13H2,1H3,(H,26,27)InChIKey
OJBHVMUPYXJLKZ-UHFFFAOYSA-NSynonyms
3(10(2(4methoxyphenoxy)ethyl)4oxo(124)triazino(43a)benzimidazol3yl)propanoicacid
3(10(2(4methoxyphenoxy)ethyl)4oxo410dihydro(124)triazino(43a)benzimidazol3yl)propanoicacid
COC1=CC=C(C=C1)OCCN2C3=CC=CC=C3N4C2=NN=C(C4=O)CCC(=O)O
InChI=1SC21H20N4O5c129146815(9714)3013122417423518(17)2520(28)16(101119(26)27)222321(24)25h29H1013H21H3(H2627)
MFCD10038875
ZINC000015085004
ZINC15085004
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