Vitas-M small molecule compound
(5E)-5-[(1-butyl-2,3-dihydro-1H-indol-5-yl)methylidene]-3-(4-fluorophenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Catalog ID
STL051293
SMILES CCCCN1CCc2c1ccc(c2)/C=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)F)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 C23H22FN3O3 MW 407.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22FN3O3/c1-2-3-11-26-12-10-16-13-15(4-9-20(16)26)14-19-21(28)25-23(30)27(22(19)29)18-7-5-17(24)6-8-18/h4-9,13-14H,2-3,10-12H2,1H3,(H,25,28,30)/b19-14+InChIKey
NBYSTTFSKDWFCD-XMHGGMMESA-NSynonyms
578744-49-7(5E)5((1butyl23dihydro1Hindol5yl)methylidene)3(4fluorophenyl)6hydroxypyrimidine24(3H5H)dione
(5E)5((1BUTYL23DIHYDROINDOL5YL)METHYLIDENE)1(4FLUOROPHENYL)13DIAZINANE246TRIONE
578744497
CCCCN1CCC2=C1C=CC(=C2)C=C3C(=O)NC(=O)N(C3=O)C4=CC=C(C=C4)F
CCCCN1CCc2c1ccc(c2)C=C1C(=NC(=O)N(C1=O)c1ccc(cc1)F)O
InChI=1SC23H22FN3O3c12311261210161315(4920(16)26)141921(28)2523(30)27(22(19)29)187517(24)6818h491314H231012H21H3(H252830)b1914+
MFCD05726688
ZINC000005032918
ZINC5032918
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