Vitas-M small molecule compound
3-{(Z)-[3-(3-ethoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-[4-(2-fluorophenyl)piperazin-1-yl]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STL052115
SMILES CCOCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccccc2F)/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 C28H30FN5O3S2 MW 567.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30FN5O3S2/c1-3-37-16-6-11-33-27(36)23(39-28(33)38)17-20-25(30-24-10-9-19(2)18-34(24)26(20)35)32-14-12-31(13-15-32)22-8-5-4-7-21(22)29/h4-5,7-10,17-18H,3,6,11-16H2,1-2H3/b23-17-InChIKey
HDKPEJQOTNTPHI-QJOMJCCJSA-NSynonyms
(5Z)3(3ETHOXYPROPYL)5((2(4(2FLUOROPHENYL)PIPERAZIN1YL)7METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(3ethoxypropyl)5((2(4(2fluorophenyl)piperazin1yl)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(3ethoxypropyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2(4(2fluorophenyl)piperazin1yl)7methyl4Hpyrido(12a)pyrimidin4one
CCOCCCN1C(=O)C(=CC2=C(N=C3C=CC(=CN3C2=O)C)N4CCN(CC4)C5=CC=CC=C5F)SC1=S
CCOCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccccc2F)C1=O
InChI=1SC28H30FN5O3S2c1337166113327(36)23(3928(33)38)172025(302410919(2)1834(24)26(20)35)32141231(131532)22854721(22)29h457101718H361116H212H3b2317
MFCD03665902
ZINC000097965928
ZINC97965928
Check stock
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Check stock on Vitas-MAvailable files
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