Vitas-M small molecule compound
2-(4-fluorophenoxy)-3-{(Z)-[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK906471
SMILES C=CCN1C(=S)S/C(=C\c2c(Oc3ccc(cc3)F)nc3n(c2=O)cccc3)/C1=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 C21H14FN3O3S2 MW 439.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14FN3O3S2/c1-2-10-25-20(27)16(30-21(25)29)12-15-18(28-14-8-6-13(22)7-9-14)23-17-5-3-4-11-24(17)19(15)26/h2-9,11-12H,1,10H2/b16-12-InChIKey
BQRYMGZCDIOVCA-VBKFSLOCSA-NSynonyms
844663-73-6(5Z)5((2(4FLUOROPHENOXY)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3PROP2ENYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3allyl5((2(4fluorophenoxy)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
2(4fluorophenoxy)3((Z)(4oxo3(prop2en1yl)2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
844663736
C=CCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)OC4=CC=C(C=C4)F)SC1=S
C=CCN1C(=S)SC(=Cc2c(Oc3ccc(cc3)F)nc3n(c2=O)cccc3)C1=O
InChI=1SC21H14FN3O3S2c12102520(27)16(3021(25)29)121518(28148613(22)7914)23175341124(17)19(15)26h291112H110H2b1612
MFCD04160270
ZINC000002405412
ZINC2405412
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