Vitas-M small molecule compound

2-(4-benzylpiperidin-1-yl)-3-[(Z)-(3-cyclohexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STK793974
SMILES S=C1S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCC(CC2)Cc2ccccc2)/C(=O)N1C1CCCCC1

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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 C30H32N4O2S2 MW 544.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H32N4O2S2/c35-28-24(20-25-29(36)34(30(37)38-25)23-11-5-2-6-12-23)27(31-26-13-7-8-16-33(26)28)32-17-14-22(15-18-32)19-21-9-3-1-4-10-21/h1,3-4,7-10,13,16,20,22-23H,2,5-6,11-12,14-15,17-19H2/b25-20-
InChIKey
FMCATSQBDFCZEJ-QQTULTPQSA-N
Synonyms

(5Z)5((2(4BENZYLPIPERIDIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3CYCLOHEXYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(4benzylpiperidin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3cyclohexyl2thioxothiazolidin4one
2(4benzylpiperidin1yl)3((Z)(3cyclohexyl4oxo2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
3CYCLOHEXYL5((4OXO2(4BENZYLPIPERIDYL)(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)2THIOXO13THIAZOLIDIN4ONE
C1CCC(CC1)N2C(=O)C(=CC3=C(N=C4C=CC=CN4C3=O)N5CCC(CC5)CC6=CC=CC=C6)SC2=S
InChI=1SC30H32N4O2S2c352824(202529(36)34(30(37)3825)23115261223)27(312613781633(26)28)32171422(151832)192193141021h1347101316202223H256111214151719H2b2520
MFCD02986356
S=C1SC(=Cc2c(nc3n(c2=O)cccc3)N2CCC(CC2)Cc2ccccc2)C(=O)N1C1CCCCC1
ZINC000100756645
ZINC100756645

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Available files

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