Vitas-M small molecule compound
3-{(Z)-[3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(butan-2-ylamino)-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK541660
SMILES CCC(Nc1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccc2c(c1)OCO2)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 C25H24N4O4S2 MW 508.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O4S2/c1-4-15(3)26-21-17(23(30)28-9-5-6-14(2)22(28)27-21)11-20-24(31)29(25(34)35-20)12-16-7-8-18-19(10-16)33-13-32-18/h5-11,15,26H,4,12-13H2,1-3H3/b20-11-InChIKey
ZLSSCWQRMINVPZ-JAIQZWGSSA-NSynonyms
487034-26-4(5Z)3(13BENZODIOXOL5YLMETHYL)5((2(BUTAN2YLAMINO)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(benzo(d)(13)dioxol5ylmethyl)5((2(secbutylamino)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(13benzodioxol5ylmethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2(butan2ylamino)9methyl4Hpyrido(12a)pyrimidin4one
487034264
CCC(C)NC1=C(C(=O)N2C=CC=C(C2=N1)C)C=C3C(=O)N(C(=S)S3)CC4=CC5=C(C=C4)OCO5
CCC(Nc1nc2c(C)cccn2c(=O)c1C=C1SC(=S)N(C1=O)Cc1ccc2c(c1)OCO2)C
InChI=1SC25H24N4O4S2c1415(3)262117(23(30)2895614(2)22(28)2721)112024(31)29(25(34)3520)1216781819(1016)33133218h5111526H41213H213H3b2011
MFCD03287186
ZINC000002322331
ZINC000008769805
Check stock
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Check stock on Vitas-MAvailable files
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