Vitas-M small molecule compound

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

Catalog ID
STL363422
SMILES COc1ccc(cc1)CCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)C)/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 C26H27N5O3S2 MW 521.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5O3S2/c1-28-13-15-29(16-14-28)23-20(24(32)30-11-4-3-5-22(30)27-23)17-21-25(33)31(26(35)36-21)12-10-18-6-8-19(34-2)9-7-18/h3-9,11,17H,10,12-16H2,1-2H3/b21-17-
InChIKey
WLEWIAAZNUTLNG-FXBPSFAMSA-N
Synonyms
615275-46-2
(5Z)3(2(4METHOXYPHENYL)ETHYL)5((2(4METHYLPIPERAZIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(4methoxyphenethyl)5((2(4methylpiperazin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(2(4methoxyphenyl)ethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2(4methylpiperazin1yl)4Hpyrido(12a)pyrimidin4one
3(2(4METHOXYPHENYL)ETHYL)5((2(4METHYLPIPERAZINYL)4OXO(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)2THIOXO13THIAZOLIDIN4ONE
615275462
CN1CCN(CC1)C2=C(C(=O)N3C=CC=CC3=N2)C=C4C(=O)N(C(=S)S4)CCC5=CC=C(C=C5)OC
COc1ccc(cc1)CCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3)N2CCN(CC2)C)C1=O
InChI=1SC26H27N5O3S2c128131529(161428)2320(24(32)301143522(30)2723)172125(33)31(26(35)3621)1210186819(342)9718h391117H101216H212H3b2117
MFCD03666202
ZINC000009411949
ZINC9411949

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Available files

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