Vitas-M small molecule compound

3-{(Z)-[3-(1,3-benzodioxol-5-ylmethyl)-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
STK794016
SMILES S=C1S/C(=C\c2c(NCC3CCCO3)nc3n(c2=O)cccc3)/C(=O)N1Cc1ccc2c(c1)OCO2

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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 C25H22N4O5S2 MW 522.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N4O5S2/c30-23-17(22(26-12-16-4-3-9-32-16)27-21-5-1-2-8-28(21)23)11-20-24(31)29(25(35)36-20)13-15-6-7-18-19(10-15)34-14-33-18/h1-2,5-8,10-11,16,26H,3-4,9,12-14H2/b20-11-
InChIKey
IMPOSTVHAGFZGF-JAIQZWGSSA-N
Synonyms
1019776-32-9
(5Z)3(13BENZODIOXOL5YLMETHYL)5((4OXO2(OXOLAN2YLMETHYLAMINO)PYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(benzo(d)(13)dioxol5ylmethyl)5((4oxo2(((tetrahydrofuran2yl)methyl)amino)4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
1019776329
3((Z)(3(13benzodioxol5ylmethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2((tetrahydrofuran2ylmethyl)amino)4Hpyrido(12a)pyrimidin4one
C1CC(OC1)CNC2=C(C(=O)N3C=CC=CC3=N2)C=C4C(=O)N(C(=S)S4)CC5=CC6=C(C=C5)OCO6
InChI=1SC25H22N4O5S2c302317(22(2612164393216)2721512828(21)23)112024(31)29(25(35)3620)1315671819(1015)34143318h125810111626H3491214H2b2011
MFCD03294168
S=C1SC(=Cc2c(NCC3CCCO3)nc3n(c2=O)cccc3)C(=O)N1Cc1ccc2c(c1)OCO2
ZINC000002193750
ZINC000100763687

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Available files

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