Vitas-M small molecule compound

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

Catalog ID
STK601112
SMILES CCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccc(cc2)OC)/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 C27H29N5O3S2 MW 535.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O3S2/c1-4-11-31-26(34)22(37-27(31)36)16-21-24(28-23-10-5-18(2)17-32(23)25(21)33)30-14-12-29(13-15-30)19-6-8-20(35-3)9-7-19/h5-10,16-17H,4,11-15H2,1-3H3/b22-16-
InChIKey
ZFXUOQOJUCWKKD-JWGURIENSA-N
Synonyms
615273-14-8
(5Z)5((2(4(4METHOXYPHENYL)PIPERAZIN1YL)7METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3PROPYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(4(4methoxyphenyl)piperazin1yl)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3propyl2thioxothiazolidin4one
2(4(4methoxyphenyl)piperazin1yl)7methyl3((Z)(4oxo3propyl2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
5((2(4(4METHOXYPHENYL)PIPERAZINYL)7METHYL4OXO(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)3PROPYL2THIOXO13THIAZOLIDIN4ONE
615273148
CCCN1C(=O)C(=CC2=C(N=C3C=CC(=CN3C2=O)C)N4CCN(CC4)C5=CC=C(C=C5)OC)SC1=S
CCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccc(cc2)OC)C1=O
InChI=1SC27H29N5O3S2c14113126(34)22(3727(31)36)162124(282310518(2)1732(23)25(21)33)30141229(131530)196820(353)9719h5101617H41115H213H3b2216
MFCD03662885
ZINC000100861011
ZINC100861011

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Available files

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