Vitas-M small molecule compound
ethyl 2-(3-{(E)-[1-(3,5-dimethylphenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}-2,5-dimethyl-1H-pyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK604935
SMILES CCOC(=O)c1c(sc2c1CCCC2)n1c(C)cc(c1C)/C=C/1\C(=NC(=O)N(C1=O)c1cc(C)cc(c1)C)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 C30H31N3O5S MW 545.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H31N3O5S/c1-6-38-29(36)25-22-9-7-8-10-24(22)39-28(25)32-18(4)14-20(19(32)5)15-23-26(34)31-30(37)33(27(23)35)21-12-16(2)11-17(3)13-21/h11-15H,6-10H2,1-5H3,(H,31,34,37)/b23-15+InChIKey
STLJGNYCVZTFBY-HZHRSRAPSA-NSynonyms
CCOC(=O)c1c(sc2c1CCCC2)n1c(C)cc(c1C)C=C1C(=NC(=O)N(C1=O)c1cc(C)cc(c1)C)O
ethyl2(3((E)(1(35dimethylphenyl)4hydroxy26dioxo16dihydropyrimidin5(2H)ylidene)methyl)25dimethyl1Hpyrrol1yl)4567tetrahydro1benzothiophene3carboxylate
MFCD08729560
ZINC000002293810
ZINC2293810
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Check stock on Vitas-MAvailable files
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