Vitas-M small molecule compound
(5E)-5-{1-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]ethylidene}-6-hydroxy-3-phenylpyrimidine-2,4(3H,5H)-dione
Catalog ID
STL040698
SMILES OC1=NC(=O)N(C(=O)/C/1=C(/Nc1c(=O)n(n(c1C)C)c1ccccc1)\C)c1ccccc1
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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 C23H21N5O4 MW 431.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N5O4/c1-14(18-20(29)25-23(32)27(21(18)30)16-10-6-4-7-11-16)24-19-15(2)26(3)28(22(19)31)17-12-8-5-9-13-17/h4-13,24H,1-3H3,(H,25,29,32)/b18-14+InChIKey
IBJQCOOBQPDYLJ-NBVRZTHBSA-NSynonyms
(5E)5(1((15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)amino)ethylidene)6hydroxy3phenylpyrimidine24(3H5H)dione
(5E)5(1((15DIMETHYL3OXO2PHENYLPYRAZOL4YL)AMINO)ETHYLIDENE)1PHENYL13DIAZINANE246TRIONE
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=C3C(=O)NC(=O)N(C3=O)C4=CC=CC=C4)C
InChI=1SC23H21N5O4c114(1820(29)2523(32)27(21(18)30)16106471116)241915(2)26(3)28(22(19)31)17128591317h41324H13H3(H252932)b1814+
MFCD05733307
OC1=NC(=O)N(C(=O)C1=C(Nc1c(=O)n(n(c1C)C)c1ccccc1)C)c1ccccc1
ZINC000101087795
ZINC101087795
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