Vitas-M small molecule compound

3-[(Z)-(3-ethyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-[4-(2-hydroxyethyl)piperazin-1-yl]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STK876645
SMILES OCCN1CCN(CC1)c1nc2ccc(cn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CC)C

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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 C21H25N5O3S2 MW 459.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5O3S2/c1-3-25-20(29)16(31-21(25)30)12-15-18(24-8-6-23(7-9-24)10-11-27)22-17-5-4-14(2)13-26(17)19(15)28/h4-5,12-13,27H,3,6-11H2,1-2H3/b16-12-
InChIKey
GCIINRLEGGGBJJ-VBKFSLOCSA-N
Synonyms
499118-84-2
(5Z)3ETHYL5((2(4(2HYDROXYETHYL)PIPERAZIN1YL)7METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3ethyl5((2(4(2hydroxyethyl)piperazin1yl)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3ethyl4oxo2thioxo13thiazolidin5ylidene)methyl)2(4(2hydroxyethyl)piperazin1yl)7methyl4Hpyrido(12a)pyrimidin4one
3ETHYL5((2(4(2HYDROXYETHYL)PIPERAZINYL)7METHYL4OXO(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)2THIOXO13THIAZOLIDIN4ONE
499118842
CCN1C(=O)C(=CC2=C(N=C3C=CC(=CN3C2=O)C)N4CCN(CC4)CCO)SC1=S
InChI=1SC21H25N5O3S2c132520(29)16(3121(25)30)121518(248623(7924)101127)22175414(2)1326(17)19(15)28h45121327H3611H212H3b1612
MFCD03302624
OCCN1CCN(CC1)c1nc2ccc(cn2c(=O)c1C=C1SC(=S)N(C1=O)CC)C
ZINC000020103358
ZINC20103358

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Available files

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