Vitas-M small molecule compound
methyl N-{(E)-[1-(4-ethoxyphenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}tryptophanate
Catalog ID
STL051093
SMILES CCOc1ccc(cc1)N1C(=O)N=C(/C(=C\NC(C(=O)OC)Cc2c[nH]c3c2cccc3)/C1=O)O
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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 C25H24N4O6 MW 476.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O6/c1-3-35-17-10-8-16(9-11-17)29-23(31)19(22(30)28-25(29)33)14-27-21(24(32)34-2)12-15-13-26-20-7-5-4-6-18(15)20/h4-11,13-14,21,26-27H,3,12H2,1-2H3,(H,28,30,33)/b19-14+InChIKey
ZYJJPICZPZQJHL-XMHGGMMESA-NSynonyms
CCOc1ccc(cc1)N1C(=O)N=C(C(=CNC(C(=O)OC)Cc2c(nH)c3c2cccc3)C1=O)O
InChI=1SC25H24N4O6c13351710816(91117)2923(31)19(22(30)2825(29)33)142721(24(32)342)1215132620754618(15)20h4111314212627H312H212H3(H283033)b1914+
METHYL2(((E)(1(4ETHOXYPHENYL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)AMINO)3(1HINDOL3YL)PROPANOATE
methylN((E)(1(4ethoxyphenyl)4hydroxy26dioxo16dihydropyrimidin5(2H)ylidene)methyl)tryptophanate
MFCD05737764
ZINC000101036744
ZINC000101036748
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