Vitas-M small molecule compound
(5E)-5-[(1-butyl-2,3-dihydro-1H-indol-5-yl)methylidene]-3-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxypyrimidine-2,4(3H,5H)-dione
Catalog ID
STL048438
SMILES CCCCN1CCc2c1ccc(c2)/C=C/1\C(=NC(=O)N(C1=O)CCc1ccc(c(c1)OC)OC)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 C27H31N3O5 MW 477.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N3O5/c1-4-5-12-29-13-11-20-15-19(6-8-22(20)29)16-21-25(31)28-27(33)30(26(21)32)14-10-18-7-9-23(34-2)24(17-18)35-3/h6-9,15-17H,4-5,10-14H2,1-3H3,(H,28,31,33)/b21-16+InChIKey
VKOCVYOUDSHGAX-LTGZKZEYSA-NSynonyms
(5E)5((1butyl23dihydro1Hindol5yl)methylidene)3(2(34dimethoxyphenyl)ethyl)6hydroxypyrimidine24(3H5H)dione
(5E)5((1BUTYL23DIHYDROINDOL5YL)METHYLIDENE)1(2(34DIMETHOXYPHENYL)ETHYL)13DIAZINANE246TRIONE
578700319
CCCCN1CCC2=C1C=CC(=C2)C=C3C(=O)NC(=O)N(C3=O)CCC4=CC(=C(C=C4)OC)OC
CCCCN1CCc2c1ccc(c2)C=C1C(=NC(=O)N(C1=O)CCc1ccc(c(c1)OC)OC)O
InChI=1SC27H31N3O5c14512291311201519(6822(20)29)162125(31)2827(33)30(26(21)32)1410187923(342)24(1718)353h691517H451014H213H3(H283133)b2116+
MFCD05725468
ZINC000009425324
ZINC09425324
ZINC9425324
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