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Vitas-M small molecule compound

6-[(1H-benzimidazol-2-ylsulfanyl)methyl]-2-[(6-methoxy-4-methylquinazolin-2-yl)amino]pyrimidin-4-ol

Catalog ID
STK017630
SMILES COc1ccc2c(c1)c(C)nc(n2)Nc1nc(O)cc(n1)CSc1nc2c([nH]1)cccc2

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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 C22H19N7O2S MW 445.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N7O2S/c1-12-15-10-14(31-2)7-8-16(15)25-20(23-12)29-21-24-13(9-19(30)28-21)11-32-22-26-17-5-3-4-6-18(17)27-22/h3-10H,11H2,1-2H3,(H,26,27)(H2,23,24,25,28,29,30)
InChIKey
XWSYQZVZZMFGFW-UHFFFAOYSA-N
Synonyms
362000-44-0
362000440
4PYRIMIDINOL6((1HBENZIMIDAZOL2YLTHIO)METHYL)2((6METHOXY4METHYL2QUINAZOLINYL)AMINO)
6(((1Hbenzo(d)imidazol2yl)thio)methyl)2((6methoxy4methylquinazolin2yl)amino)pyrimidin4ol
6((1HBENZIMIDAZOL2YLSULFANYL)METHYL)2((6METHOXY4METHYLQUINAZOLIN2YL)AMINO)PYRIMIDIN4(3H)ONE
6((1HBENZIMIDAZOL2YLSULFANYL)METHYL)2((6METHOXY4METHYLQUINAZOLIN2YL)AMINO)PYRIMIDIN4OL
6((1HBENZIMIDAZOL2YLTHIO)METHYL)2((6METHOXY4METHYL2QUINAZOLINYL)AMINO)1HPYRIMIDIN4ONE
6((1HBENZIMIDAZOL2YLTHIO)METHYL)2((6METHOXY4METHYLQUINAZOLIN2YL)AMINO)1HPYRIMIDIN4ONE
6(1HBENZIMIDAZOL2YLSULFANYLMETHYL)2((6METHOXY4METHYLQUINAZOLIN2YL)AMINO)1HPYRIMIDIN4ONE
6(1HBENZOIMIDAZOL2YLSULFANYLMETHYL)2(6METHOXY4METHYLQUINAZOLIN2YLAMINO)PYRIMIDIN4OL
6(1HBENZOMIDAZOL2YLSULFANYLMETHYL)2(6METHOXY4METHYLQUINAZOLINE2YLAMINO)PYRIMIDIN4OL
CC1=NC(=NC2=C1C=C(C=C2)OC)NC3=NC(=O)C=C(N3)CSC4=NC5=CC=CC=C5N4
COc1ccc2c(c1)c(C)nc(n2)Nc1nc(O)cc(n1)CSc1nc2c((nH)1)cccc2
InChI=1SC22H19N7O2Sc112151014(312)7816(15)2520(2312)29212413(919(30)2821)1132222617534618(17)2722h310H11H212H3(H2627)(H2232425282930)
MFCD01948140
STK017630
ZINC15987756

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Available files

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

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