Vitas-M small molecule compound
2-[3-(4-chlorophenyl)-2-ethyl-6-oxopyrazolo[1,5-a]pyrido[3,4-e]pyrimidin-7(6H)-yl]propanoic acid
Catalog ID
STL198165
SMILES CCc1nn2c(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 C20H17ClN4O3 MW 396.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClN4O3/c1-3-15-17(12-4-6-13(21)7-5-12)18-22-10-14-16(25(18)23-15)8-9-24(19(14)26)11(2)20(27)28/h4-11H,3H2,1-2H3,(H,27,28)InChIKey
NBQNCTCWINVWKI-UHFFFAOYSA-NSynonyms
2(3(4chlorophenyl)2ethyl6oxopyrazolo(15a)pyrido(34e)pyrimidin7(6H)yl)propanoicacid
CCC1=NN2C3=C(C=NC2=C1C4=CC=C(C=C4)Cl)C(=O)N(C=C3)C(C)C(=O)O
InChI=1SC20H17ClN4O3c131517(124613(21)7512)1822101416(25(18)2315)8924(19(14)26)11(2)20(27)28h411H3H212H3(H2728)
MFCD15197870
ZINC000040397479
ZINC000040397481
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