Vitas-M small molecule compound
6-methyl-2-sulfanyl-3-[1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1H-pyrazol-3-yl]thieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK436892
SMILES Sc1nc2sc(cc2c(=O)n1c1ccn(n1)C12CC3CC(C2)CC(C1)C3)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 C20H22N4OS2 MW 398.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4OS2/c1-11-4-15-17(27-11)21-19(26)24(18(15)25)16-2-3-23(22-16)20-8-12-5-13(9-20)7-14(6-12)10-20/h2-4,12-14H,5-10H2,1H3,(H,21,26)InChIKey
SPUNFGZFTBHOHJ-UHFFFAOYSA-NSynonyms
3(1(1ADAMANTYL)PYRAZOL3YL)6METHYL2SULFANYLIDENE1HTHIENO(23D)PYRIMIDIN4ONE
3(1ADAMANTANYLPYRAZOL3YL)6METHYL2SULFANYL3HYDROTHIOPHENO(23D)PYRIMIDIN4ONE
6methyl2sulfanyl3(1(tricyclo(3311~37~)dec1yl)1Hpyrazol3yl)thieno(23d)pyrimidin4(3H)one
CC1=CC2=C(S1)NC(=S)N(C2=O)C3=NN(C=C3)C45CC6CC(C4)CC(C6)C5
InChI=1SC20H22N4OS2c11141517(2711)2119(26)24(18(15)25)162323(2216)20812513(920)714(612)1020h241214H510H21H3(H2126)
ZINC000017081580
ZINC17081580
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