Vitas-M small molecule compound

1-benzyl-7-(furan-2-yl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione

Catalog ID
STK769578
SMILES O=c1[nH]c(=O)n(c2c1C(N=C(N2)c1ccco1)(C(F)(F)F)C(F)(F)F)Cc1ccccc1

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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 C19H12F6N4O3 MW 458.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12F6N4O3/c20-18(21,22)17(19(23,24)25)12-14(26-13(28-17)11-7-4-8-32-11)29(16(31)27-15(12)30)9-10-5-2-1-3-6-10/h1-8H,9H2,(H,26,28)(H,27,30,31)
InChIKey
INGIGKYMXPJJPC-UHFFFAOYSA-N
Synonyms

1BENZYL7(2FURYL)55BIS(TRIFLUOROMETHYL)58DIHYDROPYRIMIDO(45D)PYRIMIDINE24(1H3H)DIONE
1BENZYL7(2FURYL)55BIS(TRIFLUOROMETHYL)8HPYRIMIDO(45D)PYRIMIDINE24QUINONE
1benzyl7(furan2yl)55bis(trifluoromethyl)58dihydropyrimido(45d)pyrimidine24(1H3H)dione
1BENZYL7(FURAN2YL)55BIS(TRIFLUOROMETHYL)8HPYRIMIDO(45D)PYRIMIDINE24DIONE
7(2FURANYL)1(PHENYLMETHYL)55BIS(TRIFLUOROMETHYL)8HPYRIMIDO(45D)PYRIMIDINE24DIONE
7(FURAN2YL)1(PHENYLMETHYL)55BIS(TRIFLUOROMETHYL)8HPYRIMIDO(45D)PYRIMIDINE24DIONE
C1=CC=C(C=C1)CN2C3=C(C(=O)NC2=O)C(N=C(N3)C4=CC=CO4)(C(F)(F)F)C(F)(F)F
InChI=1SC19H12F6N4O3c2018(2122)17(19(2324)25)1214(2613(2817)117483211)29(16(31)2715(12)30)9105213610h18H9H2(H2628)(H273031)
MFCD03409356
O=c1(nH)c(=O)n(c2c1C(N=C(N2)c1ccco1)(C(F)(F)F)C(F)(F)F)Cc1ccccc1
ZINC000012376610
ZINC12376610

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Available files

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