Vitas-M small molecule compound
3-{10-[2-(4-chlorophenoxy)ethyl]-4-oxo-4,10-dihydro[1,2,4]triazino[4,3-a]benzimidazol-3-yl}propanoic acid
Catalog ID
STK988611
SMILES OC(=O)CCc1nnc2n(c1=O)c1ccccc1n2CCOc1ccc(cc1)Cl
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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 C20H17ClN4O4 MW 412.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClN4O4/c21-13-5-7-14(8-6-13)29-12-11-24-16-3-1-2-4-17(16)25-19(28)15(9-10-18(26)27)22-23-20(24)25/h1-8H,9-12H2,(H,26,27)InChIKey
ZXATXGZZBCKALZ-UHFFFAOYSA-NSynonyms
3(10(2(4chlorophenoxy)ethyl)4oxo(124)triazino(43a)benzimidazol3yl)propanoicacid
3(10(2(4chlorophenoxy)ethyl)4oxo410dihydro(124)triazino(43a)benzimidazol3yl)propanoicacid
C1=CC=C2C(=C1)N(C3=NN=C(C(=O)N23)CCC(=O)O)CCOC4=CC=C(C=C4)Cl
InChI=1SC20H17ClN4O4c21135714(8613)2912112416312417(16)2519(28)15(91018(26)27)222320(24)25h18H912H2(H2627)
MFCD18184506
ZINC000051325904
ZINC51325904
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