Vitas-M small molecule compound
(5Z)-5-{[(1,3-benzodioxol-5-ylmethyl)amino]methylidene}-3-[2-(4-fluorophenyl)ethyl]-6-hydroxypyrimidine-2,4(3H,5H)-dione
Catalog ID
STK563655
SMILES Fc1ccc(cc1)CCN1C(=O)N=C(/C(=C/NCc2ccc3c(c2)OCO3)/C1=O)O
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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 C21H18FN3O5 MW 411.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18FN3O5/c22-15-4-1-13(2-5-15)7-8-25-20(27)16(19(26)24-21(25)28)11-23-10-14-3-6-17-18(9-14)30-12-29-17/h1-6,9,11,23H,7-8,10,12H2,(H,24,26,28)/b16-11-InChIKey
VMQCDHZIZSZRRG-WJDWOHSUSA-NSynonyms
(5Z)1(2(4FLUOROPHENYL)ETHYL)5((PIPERONYLAMINO)METHYLENE)BARBITURICACID
(5Z)5(((13benzodioxol5ylmethyl)amino)methylidene)3(2(4fluorophenyl)ethyl)6hydroxypyrimidine24(3H5H)dione
(5Z)5((13BENZODIOXOL5YLMETHYLAMINO)METHYLIDENE)1(2(4FLUOROPHENYL)ETHYL)13DIAZINANE246TRIONE
5(1((BENZO(13)DIOXOL5YLMETHYL)AMINO)METH(Z)YLIDENE)1(2(4FLUOROPHENYL)ETHYL)PYRIMIDINE246TRIONE
C1OC2=C(O1)C=C(C=C2)CNC=C3C(=O)NC(=O)N(C3=O)CCC4=CC=C(C=C4)F
Fc1ccc(cc1)CCN1C(=O)N=C(C(=CNCc2ccc3c(c2)OCO3)C1=O)O
InChI=1SC21H18FN3O5c22154113(2515)782520(27)16(19(26)2421(25)28)11231014361718(914)30122917h1691123H781012H2(H242628)b1611
MFCD04081569
ZINC000005763410
ZINC05763410
ZINC5763410
Check stock
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Check stock on Vitas-MAvailable files
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