Vitas-M small molecule compound
ethyl 4-(3-{(E)-[1-(4-ethylphenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-2,5-dimethyl-1H-pyrrol-1-yl)benzoate
Catalog ID
STK629710
SMILES CCOC(=O)c1ccc(cc1)n1c(C)cc(c1C)/C=C/1\C(=O)N=C(N(C1=O)c1ccc(cc1)CC)S
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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 C28H27N3O4S MW 501.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N3O4S/c1-5-19-7-11-23(12-8-19)31-26(33)24(25(32)29-28(31)36)16-21-15-17(3)30(18(21)4)22-13-9-20(10-14-22)27(34)35-6-2/h7-16H,5-6H2,1-4H3,(H,29,32,36)/b24-16+InChIKey
LBCABXFCALEDNV-LFVJCYFKSA-NSynonyms
332355-78-9CCOC(=O)c1ccc(cc1)n1c(C)cc(c1C)C=C1C(=O)N=C(N(C1=O)c1ccc(cc1)CC)S
MFCD09794473
ZINC000000858028
Check stock
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Check stock on Vitas-MAvailable files
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