Vitas-M small molecule compound
2-[7-(ethylsulfanyl)-4-oxopyrimido[4,5-d]pyrimidin-3(4H)-yl]-N-[2-(trifluoromethyl)phenyl]acetamide
Catalog ID
STK409886
SMILES CCSc1ncc2c(n1)ncn(c2=O)CC(=O)Nc1ccccc1C(F)(F)F
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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 C17H14F3N5O2S MW 409.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14F3N5O2S/c1-2-28-16-21-7-10-14(24-16)22-9-25(15(10)27)8-13(26)23-12-6-4-3-5-11(12)17(18,19)20/h3-7,9H,2,8H2,1H3,(H,23,26)InChIKey
WXVJMFSOZQXENM-UHFFFAOYSA-NSynonyms
2(2ethylsulfanyl5oxopyrimido(45d)pyrimidin6yl)N(2(trifluoromethyl)phenyl)acetamide
2(7(ethylsulfanyl)4oxopyrimido(45d)pyrimidin3(4H)yl)N(2(trifluoromethyl)phenyl)acetamide
2(7ETHYLTHIO4OXO(3HYDROPYRIMIDINO(45D)PYRIMIDIN3YL))N(2(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
CCSC1=NC=C2C(=N1)N=CN(C2=O)CC(=O)NC3=CC=CC=C3C(F)(F)F
InChI=1SC17H14F3N5O2Sc1228162171014(2416)22925(15(10)27)813(26)2312643511(12)17(1819)20h379H28H21H3(H2326)
MFCD09779414
ZINC000020191018
ZINC20191018
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