Vitas-M small molecule compound
3-[(Z)-{3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}methyl]-9-methyl-2-(4-methylpiperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK799092
SMILES COc1cc(CCN2C(=S)S/C(=C\c3c(nc4n(c3=O)cccc4C)N3CCC(CC3)C)/C2=O)ccc1OC
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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 C29H32N4O4S2 MW 564.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N4O4S2/c1-18-9-13-31(14-10-18)26-21(27(34)32-12-5-6-19(2)25(32)30-26)17-24-28(35)33(29(38)39-24)15-11-20-7-8-22(36-3)23(16-20)37-4/h5-8,12,16-18H,9-11,13-15H2,1-4H3/b24-17-InChIKey
BHZUTRCVOSHLPC-ULJHMMPZSA-NSynonyms
(5Z)3(2(34DIMETHOXYPHENYL)ETHYL)5((9METHYL2(4METHYLPIPERIDIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
3((Z)(3(2(34dimethoxyphenyl)ethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)9methyl2(4methylpiperidin1yl)4Hpyrido(12a)pyrimidin4one
CC1CCN(CC1)C2=C(C(=O)N3C=CC=C(C3=N2)C)C=C4C(=O)N(C(=S)S4)CCC5=CC(=C(C=C5)OC)OC
COc1cc(CCN2C(=S)SC(=Cc3c(nc4n(c3=O)cccc4C)N3CCC(CC3)C)C2=O)ccc1OC
InChI=1SC29H32N4O4S2c11891331(141018)2621(27(34)32125619(2)25(32)3026)172428(35)33(29(38)3924)1511207822(363)23(1620)374h58121618H9111315H214H3b2417
MFCD03462265
ZINC000097946247
ZINC97946247
Check stock
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Check stock on Vitas-MAvailable files
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