Vitas-M small molecule compound
(5E)-1-(2-ethylphenyl)-5-{[1-(4-iodo-3-methylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK197010
SMILES CCc1ccccc1N1C(=S)NC(=O)/C(=C\c2cc(n(c2C)c2ccc(c(c2)C)I)C)/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 C26H24IN3O2S MW 569.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24IN3O2S/c1-5-18-8-6-7-9-23(18)30-25(32)21(24(31)28-26(30)33)14-19-13-16(3)29(17(19)4)20-10-11-22(27)15(2)12-20/h6-14H,5H2,1-4H3,(H,28,31,33)/b21-14+InChIKey
IPJFGXCVOAGUIE-KGENOOAVSA-NSynonyms
(5E)1(2ETHYLPHENYL)5((1(4IODO3METHYLPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
(5E)1(2ETHYLPHENYL)5((1(4IODO3METHYLPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
1(2ETHYLPHENYL)5((1(4IODO3METHYLPHENYL)25DIMETHYLPYRROL3YL)METHYLENE)2THIOXO13DIHYDROPYRIMIDINE46DIONE
CCC1=CC=CC=C1N2C(=O)C(=CC3=C(N(C(=C3)C)C4=CC(=C(C=C4)I)C)C)C(=O)NC2=S
CCc1ccccc1N1C(=S)NC(=O)C(=Cc2cc(n(c2C)c2ccc(c(c2)C)I)C)C1=O
InChI=1SC26H24IN3O2Sc1518867923(18)3025(32)21(24(31)2826(30)33)14191316(3)29(17(19)4)20101122(27)15(2)1220h614H5H214H3(H283133)b2114+
MFCD03547613
ZINC000100213185
ZINC100213185
Check stock
See real-time availability and sample size for STK197010 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.