Vitas-M small molecule compound
4-(1-ethyl-2,4,6-trioxo-2,3,4,5,6,11-hexahydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidin-5-yl)benzoic acid
Catalog ID
STK217818
SMILES CCn1c(=O)[nH]c(=O)c2c1NC1=C(C2c2ccc(cc2)C(=O)O)C(=O)c2c1cccc2
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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 C23H17N3O5 MW 415.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17N3O5/c1-2-26-20-17(21(28)25-23(26)31)15(11-7-9-12(10-8-11)22(29)30)16-18(24-20)13-5-3-4-6-14(13)19(16)27/h3-10,15,24H,2H2,1H3,(H,29,30)(H,25,28,31)InChIKey
SFHLEZUAKSOPOO-UHFFFAOYSA-NSynonyms
878439-75-94(1ethyl246trioxo2345611hexahydro1Hindeno(2156)pyrido(23d)pyrimidin5yl)benzoicacid
878439759
CCn1c(=O)(nH)c(=O)c2c1NC1=C(C2c2ccc(cc2)C(=O)O)C(=O)c2c1cccc2
CCN1C2=C(C(C3=C(N2)C4=CC=CC=C4C3=O)C5=CC=C(C=C5)C(=O)O)C(=O)NC1=O
InChI=1SC23H17N3O5c12262017(21(28)2523(26)31)15(117912(10811)22(29)30)1618(2420)13534614(13)19(16)27h3101524H2H21H3(H2930)(H252831)
MFCD07181016
ZINC000003646503
ZINC000018219696
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