Vitas-M small molecule compound
(5Z)-3-(4-fluorophenyl)-6-hydroxy-5-[5-(1H-indol-3-yl)pyrazolidin-3-ylidene]pyrimidine-2,4(3H,5H)-dione
Catalog ID
STK607557
SMILES Fc1ccc(cc1)N1C(=O)N=C(/C(=C\2/NNC(C2)c2c[nH]c3c2cccc3)/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 C21H16FN5O3 MW 405.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16FN5O3/c22-11-5-7-12(8-6-11)27-20(29)18(19(28)24-21(27)30)17-9-16(25-26-17)14-10-23-15-4-2-1-3-13(14)15/h1-8,10,16,23,25-26H,9H2,(H,24,28,30)/b18-17-InChIKey
BJHHAILVZSQEOI-ZCXUNETKSA-NSynonyms
(5Z)1(4fluorophenyl)5(5(1Hindol3yl)pyrazolidin3ylidene)13diazinane246trione(5Z)3(4fluorophenyl)6hydroxy5(5(1Hindol3yl)pyrazolidin3ylidene)pyrimidine24(3H5H)dione
C1C(NNC1=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)F)C4=CNC5=CC=CC=C54
Fc1ccc(cc1)N1C(=O)N=C(C(=C2NNC(C2)c2c(nH)c3c2cccc3)C1=O)O
Registry IDs
MFCD08734793ZINC000008770508
ZINC000008770511
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