Vitas-M small molecule compound
propan-2-yl 6-(5-bromo-2-ethoxyphenyl)-4-methyl-2-sulfanyl-1,6-dihydropyrimidine-5-carboxylate
Catalog ID
STK106083
SMILES CCOc1ccc(cc1C1NC(=NC(=C1C(=O)OC(C)C)C)S)Br
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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 C17H21BrN2O3S MW 413.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21BrN2O3S/c1-5-22-13-7-6-11(18)8-12(13)15-14(16(21)23-9(2)3)10(4)19-17(24)20-15/h6-9,15H,5H2,1-4H3,(H2,19,20,24)InChIKey
GUEHCIIYVHOOKM-UHFFFAOYSA-NSynonyms
CCOC1=C(C=C(C=C1)Br)C2C(=C(NC(=S)N2)C)C(=O)OC(C)C
InChI=1SC17H21BrN2O3Sc1522137611(18)812(13)1514(16(21)239(2)3)10(4)1917(24)2015h6915H5H214H3(H2192024)
MFCD03716337
PROPAN2YL4(5BROMO2ETHOXYPHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
PROPAN2YL6(5BROMO2ETHOXYPHENYL)4METHYL2SULFANYL16DIHYDROPYRIMIDINE5CARBOXYLATE
ZINC000005573491
ZINC000005573499
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