Vitas-M small molecule compound
6-(5-bromo-2-ethoxyphenyl)-4-methyl-N-(4-methylphenyl)-2-sulfanyl-1,6-dihydropyrimidine-5-carboxamide - propane (1:1)
Catalog ID
STK497955
SMILES CCOc1ccc(cc1C1NC(=NC(=C1C(=O)Nc1ccc(cc1)C)C)S)Br.CCC
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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 C24H30BrN3O2S MW 504.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22BrN3O2S.C3H8/c1-4-27-17-10-7-14(22)11-16(17)19-18(13(3)23-21(28)25-19)20(26)24-15-8-5-12(2)6-9-15;1-3-2/h5-11,19H,4H2,1-3H3,(H,24,26)(H2,23,25,28);3H2,1-2H3InChIKey
WBYQAATWMINWOU-UHFFFAOYSA-NSynonyms
4(5bromo2ethoxyphenyl)6methylN(4methylphenyl)2sulfanylidene34dihydro1Hpyrimidine5carboxamidepropane
6(5bromo2ethoxyphenyl)4methylN(4methylphenyl)2sulfanyl16dihydropyrimidine5carboxamidepropane(11)
CCCCCOC1=C(C=C(C=C1)Br)C2C(=C(NC(=S)N2)C)C(=O)NC3=CC=C(C=C3)C
CCOc1ccc(cc1C1NC(=NC(=C1C(=O)Nc1ccc(cc1)C)C)S)BrCCC
InChI=1SC21H22BrN3O2SC3H8c14271710714(22)1116(17)1918(13(3)2321(28)2519)20(26)24158512(2)6915132h51119H4H213H3(H2426)(H2232528)3H212H3
MFCD03995406
ZINC000032579446
ZINC000032579447
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