Vitas-M small molecule compound
ethyl 4-(6-butyl-3-methyl-5,7-dioxo-1-phenyl-1,5,6,7-tetrahydro-9H-pyrazolo[4',3':5,6]pyrido[2,3-d]pyrimidin-9-yl)benzoate
Catalog ID
STK554696
SMILES CCCCn1c(=O)nc2c(c1=O)cc1c(n2c2ccc(cc2)C(=O)OCC)n(nc1C)c1ccccc1
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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 C28H27N5O4 MW 497.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N5O4/c1-4-6-16-31-26(34)23-17-22-18(3)30-33(21-10-8-7-9-11-21)25(22)32(24(23)29-28(31)36)20-14-12-19(13-15-20)27(35)37-5-2/h7-15,17H,4-6,16H2,1-3H3InChIKey
OYSDLXAMYZPGAZ-UHFFFAOYSA-NSynonyms
840477-58-9840477589
CCCCN1C(=O)C2=CC3=C(N(C2=NC1=O)C4=CC=C(C=C4)C(=O)OCC)N(N=C3C)C5=CC=CC=C5
ethyl4(6butyl3methyl57dioxo1phenyl1567tetrahydro9Hpyrazolo(4356)pyrido(23d)pyrimidin9yl)benzoate
ethyl4(6butyl3methyl57dioxo1phenyl67dihydro1Hpyrazolo(4356)pyrido(23d)pyrimidin9(5H)yl)benzoate
ethyl4(6butyl3methyl57dioxo1phenylpyrazolo(12)pyrido(35b)pyrimidin9yl)benzoate
InChI=1SC28H27N5O4c146163126(34)23172218(3)3033(21108791121)25(22)32(24(23)2928(31)36)20141219(131520)27(35)3752h71517H4616H213H3
MFCD04006156
ZINC000002263186
ZINC2263186
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