Vitas-M small molecule compound
3-{(Z)-[3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(butylamino)-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STL334869
SMILES CCCCNc1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccc2c(c1)OCO2
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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 C25H24N4O4S2 MW 508.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O4S2/c1-3-4-9-26-21-17(23(30)28-10-5-6-15(2)22(28)27-21)12-20-24(31)29(25(34)35-20)13-16-7-8-18-19(11-16)33-14-32-18/h5-8,10-12,26H,3-4,9,13-14H2,1-2H3/b20-12-InChIKey
JBDQFJFXHIVCSX-NDENLUEZSA-NSynonyms
489465-87-4(5Z)3(13BENZODIOXOL5YLMETHYL)5((2(BUTYLAMINO)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(benzo(d)(13)dioxol5ylmethyl)5((2(butylamino)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(13benzodioxol5ylmethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2(butylamino)9methyl4Hpyrido(12a)pyrimidin4one
489465874
CCCCNC1=C(C(=O)N2C=CC=C(C2=N1)C)C=C3C(=O)N(C(=S)S3)CC4=CC5=C(C=C4)OCO5
CCCCNc1nc2c(C)cccn2c(=O)c1C=C1SC(=S)N(C1=O)Cc1ccc2c(c1)OCO2
InChI=1SC25H24N4O4S2c1349262117(23(30)28105615(2)22(28)2721)122024(31)29(25(34)3520)1316781819(1116)33143218h58101226H3491314H212H3b2012
MFCD03297885
ZINC000013595674
ZINC13595674
Check stock
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Check stock on Vitas-MAvailable files
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