Vitas-M small molecule compound

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

Catalog ID
STK877043
SMILES COCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCC(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 C22H26N4O3S2 MW 458.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4O3S2/c1-14-6-9-24(10-7-14)19-16(20(27)25-8-4-5-15(2)18(25)23-19)13-17-21(28)26(11-12-29-3)22(30)31-17/h4-5,8,13-14H,6-7,9-12H2,1-3H3/b17-13-
InChIKey
RIIFQXDXYIYSFX-LGMDPLHJSA-N
Synonyms
361994-73-2
(5Z)3(2METHOXYETHYL)5((9METHYL2(4METHYLPIPERIDIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(2methoxyethyl)5((9methyl2(4methylpiperidin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(2methoxyethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)9methyl2(4methylpiperidin1yl)4Hpyrido(12a)pyrimidin4one
361994732
CC1CCN(CC1)C2=C(C(=O)N3C=CC=C(C3=N2)C)C=C4C(=O)N(C(=S)S4)CCOC
COCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3C)N2CCC(CC2)C)C1=O
InChI=1SC22H26N4O3S2c1146924(10714)1916(20(27)2584515(2)18(25)2319)131721(28)26(1112293)22(30)3117h4581314H67912H213H3b1713
MFCD01958928
ZINC000002288309
ZINC2288309

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.