Vitas-M small molecule compound
(5E)-5-[(1-benzyl-1H-indol-3-yl)methylidene]-1-(3,4,5-trimethoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK713200
SMILES COc1c(OC)cc(cc1OC)N1C(=O)NC(=O)/C(=C\c2cn(c3c2cccc3)Cc2ccccc2)/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 C29H25N3O6 MW 511.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N3O6/c1-36-24-14-20(15-25(37-2)26(24)38-3)32-28(34)22(27(33)30-29(32)35)13-19-17-31(16-18-9-5-4-6-10-18)23-12-8-7-11-21(19)23/h4-15,17H,16H2,1-3H3,(H,30,33,35)/b22-13+InChIKey
OLPTYBMXKOCIAR-LPYMAVHISA-NSynonyms
(5E)5((1benzyl1Hindol3yl)methylidene)1(345trimethoxyphenyl)pyrimidine246(1H3H5H)trione
(5E)5((1BENZYLINDOL3YL)METHYLIDENE)1(345TRIMETHOXYPHENYL)13DIAZINANE246TRIONE
(Z)5((1benzyl1Hindol3yl)methylene)1(345trimethoxyphenyl)pyrimidine246(1H3H5H)trione
COC1=CC(=CC(=C1OC)OC)N2C(=O)C(=CC3=CN(C4=CC=CC=C43)CC5=CC=CC=C5)C(=O)NC2=O
COc1c(OC)cc(cc1OC)N1C(=O)NC(=O)C(=Cc2cn(c3c2cccc3)Cc2ccccc2)C1=O
InChI=1SC29H25N3O6c136241420(1525(372)26(24)383)3228(34)22(27(33)3029(32)35)13191731(161895461018)2312871121(19)23h41517H16H213H3(H303335)b2213+
MFCD09697408
ZINC000002276280
ZINC02276280
ZINC2276280
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