Vitas-M small molecule compound
2-(4-benzylpiperazin-1-yl)-3-[(Z)-(4-oxo-3-propyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK982828
SMILES CCCN1C(=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 C26H27N5O2S2 MW 505.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5O2S2/c1-2-11-31-25(33)21(35-26(31)34)17-20-23(27-22-10-6-7-12-30(22)24(20)32)29-15-13-28(14-16-29)18-19-8-4-3-5-9-19/h3-10,12,17H,2,11,13-16,18H2,1H3/b21-17-InChIKey
XOOFMOSSQNDFOK-FXBPSFAMSA-NSynonyms
500274-90-8(5Z)5((2(4BENZYLPIPERAZIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3PROPYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(4benzylpiperazin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3propyl2thioxothiazolidin4one
2(4benzylpiperazin1yl)3((Z)(4oxo3propyl2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
5((4OXO2(4BENZYLPIPERAZINYL)(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)3PROPYL2THIOXO13THIAZOLIDIN4ONE
500274908
CCCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CCN(CC4)CC5=CC=CC=C5)SC1=S
CCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3)N2CCN(CC2)Cc2ccccc2)C1=O
InChI=1SC26H27N5O2S2c12113125(33)21(3526(31)34)172023(272210671230(22)24(20)32)29151328(141629)18198435919h3101217H211131618H21H3b2117
MFCD03303117
ZINC000020129870
ZINC20129870
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