Vitas-M small molecule compound
ethyl 1-(2-chlorobenzyl)-4-[4-(dimethylamino)phenyl]-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK623497
SMILES CCOC(=O)C1=C(C)N(C(=S)NC1c1ccc(cc1)N(C)C)Cc1ccccc1Cl
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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 C23H26ClN3O2S MW 444.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26ClN3O2S/c1-5-29-22(28)20-15(2)27(14-17-8-6-7-9-19(17)24)23(30)25-21(20)16-10-12-18(13-11-16)26(3)4/h6-13,21H,5,14H2,1-4H3,(H,25,30)InChIKey
HOHQWDHMTGAYTR-UHFFFAOYSA-NSynonyms
929856-60-0929856600
CCOC(=O)C1=C(N(C(=S)NC1C2=CC=C(C=C2)N(C)C)CC3=CC=CC=C3Cl)C
ethyl1(2chlorobenzyl)4(4(dimethylamino)phenyl)6methyl2thioxo1234tetrahydropyrimidine5carboxylate
ethyl3((2chlorophenyl)methyl)6(4(dimethylamino)phenyl)4methyl2sulfanylidene16dihydropyrimidine5carboxylate
InChI=1SC23H26ClN3O2Sc152922(28)2015(2)27(1417867919(17)24)23(30)2521(20)16101218(131116)26(3)4h61321H514H214H3(H2530)
MFCD09791255
ZINC000009421026
ZINC000009421027
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