Vitas-M small molecule compound
(5E)-5-{[1-(2-chlorobenzyl)-2,3-dihydro-1H-indol-5-yl]methylidene}-3-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxypyrimidine-2,4(3H,5H)-dione
Catalog ID
STL048527
SMILES COc1cc(CCN2C(=O)N=C(/C(=C\c3ccc4c(c3)CCN4Cc3ccccc3Cl)/C2=O)O)ccc1OC
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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 C30H28ClN3O5 MW 546.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28ClN3O5/c1-38-26-10-8-19(17-27(26)39-2)11-14-34-29(36)23(28(35)32-30(34)37)16-20-7-9-25-21(15-20)12-13-33(25)18-22-5-3-4-6-24(22)31/h3-10,15-17H,11-14,18H2,1-2H3,(H,32,35,37)/b23-16+InChIKey
SEZDYQHDZDWIHJ-XQNSMLJCSA-NSynonyms
577982-77-5(5E)5((1((2CHLOROPHENYL)METHYL)23DIHYDROINDOL5YL)METHYLIDENE)1(2(34DIMETHOXYPHENYL)ETHYL)13DIAZINANE246TRIONE
(5E)5((1(2chlorobenzyl)23dihydro1Hindol5yl)methylidene)3(2(34dimethoxyphenyl)ethyl)6hydroxypyrimidine24(3H5H)dione
577982775
COC1=C(C=C(C=C1)CCN2C(=O)C(=CC3=CC4=C(C=C3)N(CC4)CC5=CC=CC=C5Cl)C(=O)NC2=O)OC
COc1cc(CCN2C(=O)N=C(C(=Cc3ccc4c(c3)CCN4Cc3ccccc3Cl)C2=O)O)ccc1OC
InChI=1SC30H28ClN3O5c1382610819(1727(26)392)11143429(36)23(28(35)3230(34)37)1620792521(1520)121333(25)1822534624(22)31h3101517H111418H212H3(H323537)b2316+
MFCD05731727
ZINC000002335971
ZINC02335971
ZINC2335971
Check stock
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Check stock on Vitas-MAvailable files
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