Vitas-M small molecule compound
(5E)-5-[({2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}amino)(4-chlorophenyl)methylidene]-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL441000
SMILES COc1ccc(cc1)N1C(=O)NC(=O)/C(=C(/c2ccc(cc2)Cl)\NCCc2c(C)[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 C36H31ClN4O5 MW 635.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H31ClN4O5/c1-22-29(30-20-28(16-17-31(30)39-22)46-21-23-6-4-3-5-7-23)18-19-38-33(24-8-10-25(37)11-9-24)32-34(42)40-36(44)41(35(32)43)26-12-14-27(45-2)15-13-26/h3-17,20,38-39H,18-19,21H2,1-2H3,(H,40,42,44)/b33-32+InChIKey
BXNJHEMLWINCGI-ULIFNZDWSA-NSynonyms
(5E)5(((2(5(benzyloxy)2methyl1Hindol3yl)ethyl)amino)(4chlorophenyl)methylidene)1(4methoxyphenyl)pyrimidine246(1H3H5H)trione
(5E)5((4CHLOROPHENYL)(2(2METHYL5PHENYLMETHOXY1HINDOL3YL)ETHYLAMINO)METHYLIDENE)1(4METHOXYPHENYL)13DIAZINANE246TRIONE
CC1=C(C2=C(N1)C=CC(=C2)OCC3=CC=CC=C3)CCNC(=C4C(=O)NC(=O)N(C4=O)C5=CC=C(C=C5)OC)C6=CC=C(C=C6)Cl
COc1ccc(cc1)N1C(=O)NC(=O)C(=C(c2ccc(cc2)Cl)NCCc2c(C)(nH)c3c2cc(OCc2ccccc2)cc3)C1=O
InChI=1SC36H31ClN4O5c12229(302028(161731(30)3922)4621236435723)18193833(2481025(37)11924)3234(42)4036(44)41(35(32)43)26121427(452)151326h317203839H181921H212H3(H404244)b3332+
MFCD06241088
ZINC000150349411
ZINC150349411
Check stock
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Check stock on Vitas-MAvailable files
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