Vitas-M small molecule compound
8-fluoro-3-{[(E)-(3,4,5-trimethoxyphenyl)methylidene]amino}-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Catalog ID
STK538065
SMILES COc1c(OC)cc(cc1OC)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(cc1)F
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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 C20H17FN4O5 MW 412.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17FN4O5/c1-28-14-6-10(7-15(29-2)18(14)30-3)9-22-25-19(26)17-16(24-20(25)27)12-8-11(21)4-5-13(12)23-17/h4-9,23H,1-3H3,(H,24,27)/b22-9+InChIKey
PZKCCYSCTBWXAH-LSFURLLWSA-NSynonyms
370850-98-9(E)8fluoro3((345trimethoxybenzylidene)amino)1Hpyrimido(54b)indole24(3H5H)dione
370850989
8fluoro3(((E)(345trimethoxyphenyl)methylidene)amino)1Hpyrimido(54b)indole24(3H5H)dione
8FLUORO3((E)(345TRIMETHOXYPHENYL)METHYLIDENEAMINO)15DIHYDROPYRIMIDO(54B)INDOLE24DIONE
COC1=CC(=CC(=C1OC)OC)C=NN2C(=O)C3=C(C4=C(N3)C=CC(=C4)F)NC2=O
COc1c(OC)cc(cc1OC)C=Nn1c(=O)(nH)c2c(c1=O)(nH)c1c2cc(cc1)F
InChI=1SC20H17FN4O5c12814610(715(292)18(14)303)9222519(26)1716(2420(25)27)12811(21)4513(12)2317h4923H13H3(H2427)b229+
MFCD02999827
ZINC000008856672
ZINC2310334
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