Vitas-M small molecule compound
2-[3-(4-chlorophenyl)-2-(methoxymethyl)-6-oxopyrazolo[1,5-a]pyrido[3,4-e]pyrimidin-7(6H)-yl]propanoic acid
Catalog ID
STL436098
SMILES COCc1nn2c(c1c1ccc(cc1)Cl)ncc1c2ccn(c1=O)C(C(=O)O)C
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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/c1-11(20(27)28)24-8-7-16-14(19(24)26)9-22-18-17(12-3-5-13(21)6-4-12)15(10-29-2)23-25(16)18/h3-9,11H,10H2,1-2H3,(H,27,28)InChIKey
WRLKLYLXCIPDSR-UHFFFAOYSA-NSynonyms
2(3(4chlorophenyl)2(methoxymethyl)6oxopyrazolo(15a)pyrido(34e)pyrimidin7(6H)yl)propanoicacid
CC(C(=O)O)N1C=CC2=C(C1=O)C=NC3=C(C(=NN23)COC)C4=CC=C(C=C4)Cl
InChI=1SC20H17ClN4O4c111(20(27)28)24871614(19(24)26)9221817(123513(21)6412)15(10292)2325(16)18h3911H10H212H3(H2728)
MFCD15198018
ZINC000040397817
ZINC000040397819
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