Vitas-M small molecule compound
(5E)-1-(2,3-dimethylphenyl)-5-({1-[2-oxo-2-(piperidin-1-yl)ethyl]-1H-indol-3-yl}methylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL367762
SMILES O=C(N1CCCCC1)Cn1cc(c2c1cccc2)/C=C/1\C(=O)NC(=O)N(C1=O)c1cccc(c1C)C
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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 C28H28N4O4 MW 484.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N4O4/c1-18-9-8-12-23(19(18)2)32-27(35)22(26(34)29-28(32)36)15-20-16-31(24-11-5-4-10-21(20)24)17-25(33)30-13-6-3-7-14-30/h4-5,8-12,15-16H,3,6-7,13-14,17H2,1-2H3,(H,29,34,36)/b22-15+InChIKey
KKWZNWLZUPTCCT-PXLXIMEGSA-NSynonyms
(5E)1(23dimethylphenyl)5((1(2oxo2(piperidin1yl)ethyl)1Hindol3yl)methylidene)pyrimidine246(1H3H5H)trione
(5E)1(23dimethylphenyl)5((1(2oxo2piperidin1ylethyl)indol3yl)methylidene)13diazinane246trione
CC1=C(C(=CC=C1)N2C(=O)C(=CC3=CN(C4=CC=CC=C43)CC(=O)N5CCCCC5)C(=O)NC2=O)C
InChI=1SC28H28N4O4c118981223(19(18)2)3227(35)22(26(34)2928(32)36)15201631(2411541021(20)24)1725(33)30136371430h458121516H367131417H212H3(H293436)b2215+
MFCD14709578
O=C(N1CCCCC1)Cn1cc(c2c1cccc2)C=C1C(=O)NC(=O)N(C1=O)c1cccc(c1C)C
ZINC000027549113
ZINC27549113
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