Vitas-M small molecule compound
(5E)-5-{[1-(2-chlorobenzyl)-2,3-dihydro-1H-indol-5-yl]methylidene}-6-hydroxy-3-(2-methoxyphenyl)pyrimidine-2,4(3H,5H)-dione
Catalog ID
STL042891
SMILES COc1ccccc1N1C(=O)N=C(/C(=C\c2ccc3c(c2)CCN3Cc2ccccc2Cl)/C1=O)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 C27H22ClN3O4 MW 487.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22ClN3O4/c1-35-24-9-5-4-8-23(24)31-26(33)20(25(32)29-27(31)34)15-17-10-11-22-18(14-17)12-13-30(22)16-19-6-2-3-7-21(19)28/h2-11,14-15H,12-13,16H2,1H3,(H,29,32,34)/b20-15+InChIKey
CCSZIMSVLBVOPO-HMMYKYKNSA-NSynonyms
575468-37-0(5E)5((1((2CHLOROPHENYL)METHYL)23DIHYDROINDOL5YL)METHYLIDENE)1(2METHOXYPHENYL)13DIAZINANE246TRIONE
(5E)5((1(2chlorobenzyl)23dihydro1Hindol5yl)methylidene)6hydroxy3(2methoxyphenyl)pyrimidine24(3H5H)dione
575468370
COC1=CC=CC=C1N2C(=O)C(=CC3=CC4=C(C=C3)N(CC4)CC5=CC=CC=C5Cl)C(=O)NC2=O
COc1ccccc1N1C(=O)N=C(C(=Cc2ccc3c(c2)CCN3Cc2ccccc2Cl)C1=O)O
InChI=1SC27H22ClN3O4c13524954823(24)3126(33)20(25(32)2927(31)34)151710112218(1417)121330(22)1619623721(19)28h2111415H121316H21H3(H293234)b2015+
MFCD05737845
ZINC000002375683
ZINC2375683
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