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Vitas-M small molecule compound

6-[(1H-benzimidazol-2-ylsulfanyl)methyl]-2-[(4,7-dimethylquinazolin-2-yl)amino]pyrimidin-4-ol

Catalog ID
STK077091
SMILES Oc1cc(CSc2nc3c([nH]2)cccc3)nc(n1)Nc1nc(C)c2c(n1)cc(cc2)C

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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 C22H19N7OS MW 429.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N7OS/c1-12-7-8-15-13(2)23-20(25-18(15)9-12)29-21-24-14(10-19(30)28-21)11-31-22-26-16-5-3-4-6-17(16)27-22/h3-10H,11H2,1-2H3,(H,26,27)(H2,23,24,25,28,29,30)
InChIKey
XWWORBHMPHQORH-UHFFFAOYSA-N
Synonyms
362000-49-5
362000495
6(((1Hbenzo(d)imidazol2yl)thio)methyl)2((47dimethylquinazolin2yl)amino)pyrimidin4ol
6((1HBENZIMIDAZOL2YLSULFANYL)METHYL)2((47DIMETHYLQUINAZOLIN2YL)AMINO)PYRIMIDIN4OL
6((1HBENZIMIDAZOL2YLTHIO)METHYL)2((47DIMETHYL2QUINAZOLINYL)AMINO)1HPYRIMIDIN4ONE
6((1HBENZIMIDAZOL2YLTHIO)METHYL)2((47DIMETHYL2QUINAZOLINYL)AMINO)4PYRIMIDINOL
6((1HBENZIMIDAZOL2YLTHIO)METHYL)2((47DIMETHYLQUINAZOLIN2YL)AMINO)1HPYRIMIDIN4ONE
6(1HBENZIMIDAZOL2YLSULFANYLMETHYL)2((47DIMETHYLQUINAZOLIN2YL)AMINO)1HPYRIMIDIN4ONE
6(BENZIMIDAZOL2YLTHIOMETHYL)2((47DIMETHYLQUINAZOLIN2YL)AMINO)PYRIMIDIN4OL
CC1=CC2=C(C=C1)C(=NC(=N2)NC3=NC(=O)C=C(N3)CSC4=NC5=CC=CC=C5N4)C
InChI=1SC22H19N7OSc112781513(2)2320(2518(15)912)29212414(1019(30)2821)1131222616534617(16)2722h310H11H212H3(H2627)(H2232425282930)
MFCD01946720
Oc1cc(CSc2nc3c((nH)2)cccc3)nc(n1)Nc1nc(C)c2c(n1)cc(cc2)C
STK077091
ZINC000015987821
ZINC15987821

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Available files

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