Vitas-M small molecule compound
butyl 4-(4-chlorophenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate
Catalog ID
STK914930
SMILES CCCCOC(=O)C1=C(C)Nc2n(C1c1ccc(cc1)Cl)c1ccccc1n2
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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 C22H22ClN3O2 MW 395.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN3O2/c1-3-4-13-28-21(27)19-14(2)24-22-25-17-7-5-6-8-18(17)26(22)20(19)15-9-11-16(23)12-10-15/h5-12,20H,3-4,13H2,1-2H3,(H,24,25)InChIKey
ODZWOWPOYCETCW-UHFFFAOYSA-NSynonyms
butyl4(4chlorophenyl)2methyl14dihydropyrimido(12a)benzimidazole3carboxylate
CCCCOC(=O)C1=C(NC2=NC3=CC=CC=C3N2C1C4=CC=C(C=C4)Cl)C
InChI=1SC22H22ClN3O2c134132821(27)1914(2)24222517756818(17)26(22)20(19)1591116(23)121015h51220H3413H212H3(H2425)
MFCD14730112
ZINC000004767992
ZINC000004767995
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