Vitas-M small molecule compound
3-{(Z)-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(4-fluorophenoxy)-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK906477
SMILES CCC(N1C(=S)S/C(=C\c2c(Oc3ccc(cc3)F)nc3n(c2=O)cccc3)/C1=O)C
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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 C22H18FN3O3S2 MW 455.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18FN3O3S2/c1-3-13(2)26-21(28)17(31-22(26)30)12-16-19(29-15-9-7-14(23)8-10-15)24-18-6-4-5-11-25(18)20(16)27/h4-13H,3H2,1-2H3/b17-12-InChIKey
CPTZPSZSLGYIKE-ATVHPVEESA-NSynonyms
848743-49-7(5Z)3BUTAN2YL5((2(4FLUOROPHENOXY)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(secbutyl)5((2(4fluorophenoxy)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(butan2yl)4oxo2thioxo13thiazolidin5ylidene)methyl)2(4fluorophenoxy)4Hpyrido(12a)pyrimidin4one
848743497
CCC(C)N1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)OC4=CC=C(C=C4)F)SC1=S
CCC(N1C(=S)SC(=Cc2c(Oc3ccc(cc3)F)nc3n(c2=O)cccc3)C1=O)C
InChI=1SC22H18FN3O3S2c1313(2)2621(28)17(3122(26)30)121619(29159714(23)81015)24186451125(18)20(16)27h413H3H212H3b1712
MFCD04195454
ZINC000002433327
ZINC000002433330
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