Vitas-M small molecule compound
1-(furan-2-ylmethyl)-4-hydroxy-7-(thiophen-2-yl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidin-2(1H)-one
Catalog ID
STL038451
SMILES Oc1nc(=O)n(c2c1C(N=C(N2)c1cccs1)(C(F)(F)F)C(F)(F)F)Cc1ccco1
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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 C17H10F6N4O3S MW 464.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H10F6N4O3S/c18-16(19,20)15(17(21,22)23)10-12(24-11(26-15)9-4-2-6-31-9)27(14(29)25-13(10)28)7-8-3-1-5-30-8/h1-6H,7H2,(H,24,26)(H,25,28,29)InChIKey
XLYVXUJJLBLBRD-UHFFFAOYSA-NSynonyms
606923-97-11(furan2ylmethyl)4hydroxy7(thiophen2yl)55bis(trifluoromethyl)58dihydropyrimido(45d)pyrimidin2(1H)one
1(FURAN2YLMETHYL)7(THIOPHEN2YL)55BIS(TRIFLUOROMETHYL)58DIHYDROPYRIMIDO(45D)PYRIMIDINE24(1H3H)DIONE
1(FURAN2YLMETHYL)7THIOPHEN2YL55BIS(TRIFLUOROMETHYL)8HPYRIMIDO(45D)PYRIMIDINE24DIONE
606923971
C1=COC(=C1)CN2C3=C(C(=O)NC2=O)C(N=C(N3)C4=CC=CS4)(C(F)(F)F)C(F)(F)F
InChI=1SC17H10F6N4O3Sc1816(1920)15(17(2122)23)1012(2411(2615)9426319)27(14(29)2513(10)28)78315308h16H7H2(H2426)(H252829)
MFCD04081370
ZINC000001268539
ZINC1268539
ZINC20289169
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