Vitas-M small molecule compound

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

Catalog ID
STK810909
SMILES CC1CC(C)CN(C1)c1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C1CCCC1

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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 C25H30N4O2S2 MW 482.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N4O2S2/c1-15-11-16(2)14-27(13-15)22-19(23(30)28-10-6-7-17(3)21(28)26-22)12-20-24(31)29(25(32)33-20)18-8-4-5-9-18/h6-7,10,12,15-16,18H,4-5,8-9,11,13-14H2,1-3H3/b20-12-
InChIKey
MFDKMMPDBCXAKC-NDENLUEZSA-N
Synonyms

(5Z)3CYCLOPENTYL5((2(35DIMETHYLPIPERIDIN1YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(E)3cyclopentyl5((2(35dimethylpiperidin1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3cyclopentyl4oxo2thioxo13thiazolidin5ylidene)methyl)2(35dimethylpiperidin1yl)9methyl4Hpyrido(12a)pyrimidin4one
CC1CC(C)CN(C1)c1nc2c(C)cccn2c(=O)c1C=C1SC(=S)N(C1=O)C1CCCC1
CC1CC(CN(C1)C2=C(C(=O)N3C=CC=C(C3=N2)C)C=C4C(=O)N(C(=S)S4)C5CCCC5)C
InChI=1SC25H30N4O2S2c1151116(2)1427(1315)2219(23(30)28106717(3)21(28)2622)122024(31)29(25(32)3320)18845918h671012151618H4589111314H213H3b2012
MFCD03933058
ZINC000028467583
ZINC000028467591

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Available files

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