Vitas-M small molecule compound
(5Z)-3-[2-(cyclohex-1-en-1-yl)ethyl]-6-hydroxy-5-({[2-(pyridin-3-yl)piperidin-1-yl]amino}methylidene)-2-thioxo-2,5-dihydropyrimidin-4(3H)-one
Catalog ID
STL559351
SMILES S=C1N=C(O)/C(=C/NN2CCCCC2c2cccnc2)/C(=O)N1CCC1=CCCCC1
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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 C23H29N5O2S MW 439.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N5O2S/c29-21-19(16-25-28-13-5-4-10-20(28)18-9-6-12-24-15-18)22(30)27(23(31)26-21)14-11-17-7-2-1-3-8-17/h6-7,9,12,15-16,20,25H,1-5,8,10-11,13-14H2,(H,26,29,31)/b19-16-InChIKey
BPYSPHOCVLMALG-MNDPQUGUSA-NSynonyms
(5Z)3(2(cyclohex1en1yl)ethyl)6hydroxy5(((2(pyridin3yl)piperidin1yl)amino)methylidene)2thioxo25dihydropyrimidin4(3H)one
MFCD32221204
ZINC000008974882
ZINC000008974883
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