Vitas-M small molecule compound
ethyl (2E)-2-{[1-(3,4-dichlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK674210
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)/c(=C\c1cc(n(c1C)c1ccc(c(c1)Cl)Cl)C)/s2
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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 C30H27Cl2N3O4S MW 596.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27Cl2N3O4S/c1-6-39-29(37)26-17(3)33-30-35(27(26)19-7-10-22(38-5)11-8-19)28(36)25(40-30)14-20-13-16(2)34(18(20)4)21-9-12-23(31)24(32)15-21/h7-15,27H,6H2,1-5H3/b25-14+InChIKey
RKVDHMRXIJAROZ-AFUMVMLFSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)c(=Cc1cc(n(c1C)c1ccc(c(c1)Cl)Cl)C)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)OC)C(=O)C(=CC4=C(N(C(=C4)C)C5=CC(=C(C=C5)Cl)Cl)C)S2)C
ethyl(2E)2((1(34dichlorophenyl)25dimethyl1Hpyrrol3yl)methylidene)5(4methoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2E)2((1(34DICHLOROPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)5(4METHOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC30H27Cl2N3O4Sc163929(37)2617(3)333035(27(26)1971022(385)11819)28(36)25(4030)14201316(2)34(18(20)4)2191223(31)24(32)1521h71527H6H215H3b2514+
MFCD01304957
ZINC000100065798
ZINC000100065800
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.