Vitas-M small molecule compound
(5Z)-3-(2-fluorophenyl)-6-hydroxy-5-({[3-(1H-imidazol-1-yl)propyl]amino}methylidene)pyrimidine-2,4(3H,5H)-dione
Catalog ID
STK560661
SMILES O=C1N=C(O)/C(=C/NCCCn2cncc2)/C(=O)N1c1ccccc1F
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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 C17H16FN5O3 MW 357.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16FN5O3/c18-13-4-1-2-5-14(13)23-16(25)12(15(24)21-17(23)26)10-19-6-3-8-22-9-7-20-11-22/h1-2,4-5,7,9-11,19H,3,6,8H2,(H,21,24,26)/b12-10-InChIKey
JUSCVCHRGMNPTL-BENRWUELSA-NSynonyms
(5Z)1(2fluorophenyl)5((3imidazol1ylpropylamino)methylidene)13diazinane246trione
(5Z)3(2fluorophenyl)6hydroxy5(((3(1Himidazol1yl)propyl)amino)methylidene)pyrimidine24(3H5H)dione
C1=CC=C(C(=C1)N2C(=O)C(=CNCCCN3C=CN=C3)C(=O)NC2=O)F
InChI=1SC17H16FN5O3c1813412514(13)2316(25)12(15(24)2117(23)26)10196382297201122h1245791119H368H2(H212426)b1210
MFCD03793949
O=C1N=C(O)C(=CNCCCn2cncc2)C(=O)N1c1ccccc1F
ZINC000095483788
ZINC95483788
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