Vitas-M small molecule compound

3-{(Z)-[3-(3-ethoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-[(tetrahydrofuran-2-ylmethyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STK876631
SMILES CCOCCCN1C(=S)S/C(=C\c2c(NCC3CCCO3)nc3n(c2=O)cccc3)/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 C22H26N4O4S2 MW 474.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4O4S2/c1-2-29-11-6-10-26-21(28)17(32-22(26)31)13-16-19(23-14-15-7-5-12-30-15)24-18-8-3-4-9-25(18)20(16)27/h3-4,8-9,13,15,23H,2,5-7,10-12,14H2,1H3/b17-13-
InChIKey
IVITYDXXTLDURX-LGMDPLHJSA-N
Synonyms
488824-95-9
(5Z)3(3ETHOXYPROPYL)5((4OXO2(OXOLAN2YLMETHYLAMINO)PYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(3ethoxypropyl)5((4oxo2(((tetrahydrofuran2yl)methyl)amino)4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(3ethoxypropyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2((tetrahydrofuran2ylmethyl)amino)4Hpyrido(12a)pyrimidin4one
3(3ETHOXYPROPYL)5((4OXO2((OXOLAN2YLMETHYL)AMINO)(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)2THIOXO13THIAZOLIDIN4ONE
488824959
CCOCCCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)NCC4CCCO4)SC1=S
InChI=1SC22H26N4O4S2c1229116102621(28)17(3222(26)31)131619(23141575123015)2418834925(18)20(16)27h3489131523H257101214H21H3b1713
MFCD03293885
ZINC000008858022
ZINC000008858023

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Available files

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