Vitas-M small molecule compound

6-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-2-[(6-ethyl-4-methylquinazolin-2-yl)amino]pyrimidin-4(1H)-one

Catalog ID
STK089355
SMILES CCc1ccc2c(c1)c(C)nc(n2)Nc1nc(=O)cc([nH]1)CSc1nc2c(s1)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 C23H20N6OS2 MW 460.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N6OS2/c1-3-14-8-9-17-16(10-14)13(2)24-21(26-17)29-22-25-15(11-20(30)28-22)12-31-23-27-18-6-4-5-7-19(18)32-23/h4-11H,3,12H2,1-2H3,(H2,24,25,26,28,29,30)
InChIKey
OBUCOIOUAFQXOG-UHFFFAOYSA-N
Synonyms
384793-81-1
6((13BENZOTHIAZOL2YLSULFANYL)METHYL)2(((2Z)6ETHYL4METHYLQUINAZOLIN2(3H)YLIDENE)AMINO)PYRIMIDIN4(1H)ONE
6((13BENZOTHIAZOL2YLSULFANYL)METHYL)2((6ETHYL4METHYLQUINAZOLIN2YL)AMINO)PYRIMIDIN4(1H)ONE
6((benzo(d)thiazol2ylthio)methyl)2((6ethyl4methylquinazolin2yl)amino)pyrimidin4(1H)one
6(13BENZOTHIAZOL2YLSULFANYLMETHYL)2((6ETHYL4METHYLQUINAZOLIN2YL)AMINO)1HPYRIMIDIN4ONE
CCC1=CC2=C(C=C1)N=C(N=C2C)NC3=NC(=O)C=C(N3)CSC4=NC5=CC=CC=C5S4
CCc1ccc2c(c1)c(C)nc(n2)Nc1nc(=O)cc((nH)1)CSc1nc2c(s1)cccc2
InChI=1SC23H20N6OS2c1314891716(1014)13(2)2421(2617)29222515(1120(30)2822)1231232718645719(18)3223h411H312H212H3(H2242526282930)
MFCD03176130
STK089355
ZINC17161436

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Available files

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