Vitas-M small molecule compound
2-(4-benzylpiperazin-1-yl)-3-[(Z)-(4-oxo-3-pentyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK703137
SMILES CCCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)Cc2ccccc2)/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 C28H31N5O2S2 MW 533.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N5O2S2/c1-2-3-8-14-33-27(35)23(37-28(33)36)19-22-25(29-24-12-7-9-13-32(24)26(22)34)31-17-15-30(16-18-31)20-21-10-5-4-6-11-21/h4-7,9-13,19H,2-3,8,14-18,20H2,1H3/b23-19-InChIKey
RTVXJXLRIOUELM-NMWGTECJSA-NSynonyms
500275-00-3(5Z)5((2(4BENZYLPIPERAZIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3PENTYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(4benzylpiperazin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3pentyl2thioxothiazolidin4one
2(4benzylpiperazin1yl)3((Z)(4oxo3pentyl2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
500275003
CCCCCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CCN(CC4)CC5=CC=CC=C5)SC1=S
CCCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3)N2CCN(CC2)Cc2ccccc2)C1=O
InChI=1SC28H31N5O2S2c1238143327(35)23(3728(33)36)192225(292412791332(24)26(22)34)31171530(161831)2021105461121h4791319H238141820H21H3b2319
MFCD03303124
ZINC000100840326
ZINC100840326
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