Vitas-M small molecule compound
(5E)-5-[({2-[5-(benzyloxy)-1H-indol-3-yl]ethyl}amino)(4-chlorophenyl)methylidene]-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL440962
SMILES COc1ccc(cc1)N1C(=O)NC(=O)/C(=C(/c2ccc(cc2)Cl)\NCCc2c[nH]c3c2cc(OCc2ccccc2)cc3)/C1=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 C35H29ClN4O5 MW 621.09 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H29ClN4O5/c1-44-27-13-11-26(12-14-27)40-34(42)31(33(41)39-35(40)43)32(23-7-9-25(36)10-8-23)37-18-17-24-20-38-30-16-15-28(19-29(24)30)45-21-22-5-3-2-4-6-22/h2-16,19-20,37-38H,17-18,21H2,1H3,(H,39,41,43)/b32-31+InChIKey
FJVMDVKSYPEONE-QNEJGDQOSA-NSynonyms
(5E)5(((2(5(benzyloxy)1Hindol3yl)ethyl)amino)(4chlorophenyl)methylidene)1(4methoxyphenyl)pyrimidine246(1H3H5H)trione
(5E)5((4CHLOROPHENYL)(2(5PHENYLMETHOXY1HINDOL3YL)ETHYLAMINO)METHYLIDENE)1(4METHOXYPHENYL)13DIAZINANE246TRIONE
COC1=CC=C(C=C1)N2C(=O)C(=C(C3=CC=C(C=C3)Cl)NCCC4=CNC5=C4C=C(C=C5)OCC6=CC=CC=C6)C(=O)NC2=O
COc1ccc(cc1)N1C(=O)NC(=O)C(=C(c2ccc(cc2)Cl)NCCc2c(nH)c3c2cc(OCc2ccccc2)cc3)C1=O
InChI=1SC35H29ClN4O5c14427131126(121427)4034(42)31(33(41)3935(40)43)32(237925(36)10823)37181724203830161528(1929(24)30)4521225324622h21619203738H171821H21H3(H394143)b3231+
MFCD06241049
ZINC000101380856
ZINC101380856
Check stock
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Check stock on Vitas-MAvailable files
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