Vitas-M small molecule compound

3-{(Z)-[3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(4-methylpiperazin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STK794200
SMILES CN1CCN(CC1)c1nc2ccccn2c(=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 C25H23N5O4S2 MW 521.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N5O4S2/c1-27-8-10-28(11-9-27)22-17(23(31)29-7-3-2-4-21(29)26-22)13-20-24(32)30(25(35)36-20)14-16-5-6-18-19(12-16)34-15-33-18/h2-7,12-13H,8-11,14-15H2,1H3/b20-13-
InChIKey
HPFBHVLOQQDHMO-MOSHPQCFSA-N
Synonyms
488725-48-0
(5Z)3(13BENZODIOXOL5YLMETHYL)5((2(4METHYLPIPERAZIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(benzo(d)(13)dioxol5ylmethyl)5((2(4methylpiperazin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(13benzodioxol5ylmethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2(4methylpiperazin1yl)4Hpyrido(12a)pyrimidin4one
488725480
CN1CCN(CC1)c1nc2ccccn2c(=O)c1C=C1SC(=S)N(C1=O)Cc1ccc2c(c1)OCO2
CN1CCN(CC1)C2=C(C(=O)N3C=CC=CC3=N2)C=C4C(=O)N(C(=S)S4)CC5=CC6=C(C=C5)OCO6
InChI=1SC25H23N5O4S2c12781028(11927)2217(23(31)29732421(29)2622)132024(32)30(25(35)3620)1416561819(1216)34153318h271213H8111415H21H3b2013
MFCD03291528
ZINC000008858101
ZINC8858101

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Available files

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