Vitas-M small molecule compound

2-(4-ethylpiperazin-1-yl)-9-methyl-3-{(Z)-[4-oxo-3-(3-phenylpropyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STL336125
SMILES CCN1CCN(CC1)c1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCCc1ccccc1

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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/c1-3-30-15-17-31(18-16-30)25-22(26(34)32-13-7-9-20(2)24(32)29-25)19-23-27(35)33(28(36)37-23)14-8-12-21-10-5-4-6-11-21/h4-7,9-11,13,19H,3,8,12,14-18H2,1-2H3/b23-19-
InChIKey
TWWZNJLEKBAXKC-NMWGTECJSA-N
Synonyms
797018-95-2
(5Z)5((2(4ETHYLPIPERAZIN1YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3(3PHENYLPROPYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(4ethylpiperazin1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3(3phenylpropyl)2thioxothiazolidin4one
2(4ethylpiperazin1yl)9methyl3((Z)(4oxo3(3phenylpropyl)2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
5((2(4ETHYLPIPERAZINYL)9METHYL4OXO(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)3(3PHENYLPROPYL)2THIOXO13THIAZOLIDIN4ONE
797018952
CCN1CCN(CC1)c1nc2c(C)cccn2c(=O)c1C=C1SC(=S)N(C1=O)CCCc1ccccc1
CCN1CCN(CC1)C2=C(C(=O)N3C=CC=C(C3=N2)C)C=C4C(=O)N(C(=S)S4)CCCC5=CC=CC=C5
InChI=1SC28H31N5O2S2c1330151731(181630)2522(26(34)32137920(2)24(32)2925)192327(35)33(28(36)3723)1481221105461121h479111319H38121418H212H3b2319
MFCD03663475
ZINC000100912740
ZINC100912740

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Available files

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