Vitas-M small molecule compound
7-methyl-2-(4-methylpiperazin-1-yl)-3-{(Z)-[3-(2-methylpropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK704718
SMILES CC(CN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)C)/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 C22H27N5O2S2 MW 457.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N5O2S2/c1-14(2)12-27-21(29)17(31-22(27)30)11-16-19(25-9-7-24(4)8-10-25)23-18-6-5-15(3)13-26(18)20(16)28/h5-6,11,13-14H,7-10,12H2,1-4H3/b17-11-InChIKey
XBNKXRJBNULJFX-BOPFTXTBSA-NSynonyms
496796-03-3(5Z)5((7METHYL2(4METHYLPIPERAZIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3(2METHYLPROPYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3isobutyl5((7methyl2(4methylpiperazin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
496796033
7methyl2(4methylpiperazin1yl)3((Z)(3(2methylpropyl)4oxo2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
CC(CN1C(=S)SC(=Cc2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)C)C1=O)C
CC1=CN2C(=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CC(C)C)N4CCN(CC4)C)C=C1
InChI=1SC22H27N5O2S2c114(2)122721(29)17(3122(27)30)111619(259724(4)81025)23186515(3)1326(18)20(16)28h56111314H71012H214H3b1711
MFCD03298811
ZINC000002304358
ZINC2304358
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.