Vitas-M small molecule compound
2-(4-ethylpiperazin-1-yl)-3-{(Z)-[3-(3-methoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK794156
SMILES COCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)CC)/C1=O
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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 C23H29N5O3S2 MW 487.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N5O3S2/c1-4-25-9-11-26(12-10-25)20-17(21(29)28-15-16(2)6-7-19(28)24-20)14-18-22(30)27(23(32)33-18)8-5-13-31-3/h6-7,14-15H,4-5,8-13H2,1-3H3/b18-14-InChIKey
YOPDQZBOZKKOJA-JXAWBTAJSA-NSynonyms
497240-82-1(5Z)5((2(4ETHYLPIPERAZIN1YL)7METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3(3METHOXYPROPYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(4ethylpiperazin1yl)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3(3methoxypropyl)2thioxothiazolidin4one
2(4ethylpiperazin1yl)3((Z)(3(3methoxypropyl)4oxo2thioxo13thiazolidin5ylidene)methyl)7methyl4Hpyrido(12a)pyrimidin4one
497240821
CCN1CCN(CC1)C2=C(C(=O)N3C=C(C=CC3=N2)C)C=C4C(=O)N(C(=S)S4)CCCOC
COCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)CC)C1=O
InChI=1SC23H29N5O3S2c142591126(121025)2017(21(29)281516(2)6719(28)2420)141822(30)27(23(32)3318)8513313h671415H45813H213H3b1814
MFCD03300019
ZINC000009380085
ZINC9380085
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.