Vitas-M small molecule compound
(5E)-1-(2-fluorophenyl)-5-({[3-(1H-imidazol-1-yl)propyl]amino}methylidene)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STK560659
SMILES O=C1N=C(S)N(C(=O)/C/1=C/NCCCn1ccnc1)c1ccccc1F
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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 C17H16FN5O2S MW 373.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16FN5O2S/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
RIAFFIOGXTXVRG-ZRDIBKRKSA-NSynonyms
(5E)1(2fluorophenyl)5(((3(1Himidazol1yl)propyl)amino)methylidene)2sulfanylpyrimidine46(1H5H)dione
(5E)1(2FLUOROPHENYL)5((3IMIDAZOL1YLPROPYLAMINO)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
InChI=1SC17H16FN5O2Sc1813412514(13)2316(25)12(15(24)2117(23)26)10196382297201122h1245791119H368H2(H212426)b1210+
MFCD03794895
O=C1N=C(S)N(C(=O)C1=CNCCCn1ccnc1)c1ccccc1F
ZINC000006382981
ZINC000102497807
ZINC06382981
ZINC6382981
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