Vitas-M small molecule compound
(5Z)-5-({[2-(5-fluoro-1H-indol-3-yl)ethyl]amino}[(2-methoxyphenyl)amino]methylidene)-1-(2-fluorophenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL441720
SMILES COc1ccccc1N/C(=C\1/C(=O)NC(=O)N(C1=O)c1ccccc1F)/NCCc1c[nH]c2c1cc(F)cc2
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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 C28H23F2N5O4 MW 531.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23F2N5O4/c1-39-23-9-5-3-7-21(23)33-25(31-13-12-16-15-32-20-11-10-17(29)14-18(16)20)24-26(36)34-28(38)35(27(24)37)22-8-4-2-6-19(22)30/h2-11,14-15,31-33H,12-13H2,1H3,(H,34,36,38)/b25-24-InChIKey
DBISIPUGNGDEJP-IZHYLOQSSA-NSynonyms
(5Z)5(((2(5fluoro1Hindol3yl)ethyl)amino)((2methoxyphenyl)amino)methylidene)1(2fluorophenyl)pyrimidine246(1H3H5H)trione
(5Z)5((2(5fluoro1Hindol3yl)ethylamino)(2methoxyanilino)methylidene)1(2fluorophenyl)13diazinane246trione
COC1=CC=CC=C1NC(=C2C(=O)NC(=O)N(C2=O)C3=CC=CC=C3F)NCCC4=CNC5=C4C=C(C=C5)F
COc1ccccc1NC(=C1C(=O)NC(=O)N(C1=O)c1ccccc1F)NCCc1c(nH)c2c1cc(F)cc2
InChI=1SC28H23F2N5O4c13923953721(23)3325(31131216153220111017(29)1418(16)20)2426(36)3428(38)35(27(24)37)22842619(22)30h21114153133H1213H21H3(H343638)b2524
MFCD08060424
ZINC000008777868
ZINC8777868
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