Vitas-M small molecule compound

methyl 4,8-bis(2,4-dichlorophenyl)-6-methyl-2-sulfanyl-1,8-dihydro-4H-pyrimido[1,2-a][1,3,5]triazine-7-carboxylate

Catalog ID
STL576900
SMILES COC(=O)C1=C(C)N2C(=NC1c1ccc(cc1Cl)Cl)NC(=NC2c1ccc(cc1Cl)Cl)S

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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 C21H16Cl4N4O2S MW 530.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16Cl4N4O2S/c1-9-16(19(30)31-2)17(12-5-3-10(22)7-14(12)24)26-20-28-21(32)27-18(29(9)20)13-6-4-11(23)8-15(13)25/h3-8,17-18H,1-2H3,(H2,26,27,28,32)
InChIKey
ZKRPUJFYRAUONZ-UHFFFAOYSA-N
Synonyms

145916670
InChI=1SC21H16Cl4N4O2Sc1916(19(30)312)17(125310(22)714(12)24)26202821(32)2718(29(9)20)136411(23)815(13)25h381718H12H3(H226272832)
methyl48bis(24dichlorophenyl)6methyl2sulfanyl18dihydro4Hpyrimido(12a)(135)triazine7carboxylate
methyl48bis(24dichlorophenyl)6methyl2sulfanylidene1348tetrahydropyrimido(12a)(135)triazine7carboxylate
MFCD32650507
ZINC001848443221
ZINC001848443224

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.