Vitas-M small molecule compound
2-[4-(4-fluorophenyl)piperazin-1-yl]-7-methyl-3-[(Z)-(4-oxo-3-pentyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK903866
SMILES CCCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccc(cc2)F)/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 C28H30FN5O2S2 MW 551.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30FN5O2S2/c1-3-4-5-12-33-27(36)23(38-28(33)37)17-22-25(30-24-11-6-19(2)18-34(24)26(22)35)32-15-13-31(14-16-32)21-9-7-20(29)8-10-21/h6-11,17-18H,3-5,12-16H2,1-2H3/b23-17-InChIKey
ZSZBLWWOLSOCNR-QJOMJCCJSA-NSynonyms
(5Z)5((2(4(4FLUOROPHENYL)PIPERAZIN1YL)7METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3PENTYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(4(4fluorophenyl)piperazin1yl)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3pentyl2thioxothiazolidin4one
2(4(4fluorophenyl)piperazin1yl)7methyl3((Z)(4oxo3pentyl2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
CCCCCN1C(=O)C(=CC2=C(N=C3C=CC(=CN3C2=O)C)N4CCN(CC4)C5=CC=C(C=C5)F)SC1=S
CCCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccc(cc2)F)C1=O
InChI=1SC28H30FN5O2S2c1345123327(36)23(3828(33)37)172225(302411619(2)1834(24)26(22)35)32151331(141632)219720(29)81021h6111718H351216H212H3b2317
MFCD18075964
ZINC000097947298
ZINC97947298
Check stock
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Check stock on Vitas-MAvailable files
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