Vitas-M small molecule compound

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

Catalog ID
STK794125
SMILES S=C1S/C(=C\c2c(nc3n(c2=O)cccc3)N(Cc2ccccc2)C)/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 C28H22N4O4S2 MW 542.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22N4O4S2/c1-30(15-18-7-3-2-4-8-18)25-20(26(33)31-12-6-5-9-24(31)29-25)14-23-27(34)32(28(37)38-23)16-19-10-11-21-22(13-19)36-17-35-21/h2-14H,15-17H2,1H3/b23-14-
InChIKey
FJALRRFPNDFTJK-UCQKPKSFSA-N
Synonyms
497078-28-1
(5Z)3(13BENZODIOXOL5YLMETHYL)5((2(BENZYL(METHYL)AMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(benzo(d)(13)dioxol5ylmethyl)5((2(benzyl(methyl)amino)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(13benzodioxol5ylmethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2(benzyl(methyl)amino)4Hpyrido(12a)pyrimidin4one
3(2HBENZO(34D)13DIOXOLAN5YLMETHYL)5((2(METHYLBENZYLAMINO)4OXO(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)2THIOXO13THIAZOLIDIN4ONE
497078281
CN(CC1=CC=CC=C1)C2=C(C(=O)N3C=CC=CC3=N2)C=C4C(=O)N(C(=S)S4)CC5=CC6=C(C=C5)OCO6
InChI=1SC28H22N4O4S2c130(15187324818)2520(26(33)311265924(31)2925)142327(34)32(28(37)3823)161910112122(1319)36173521h214H1517H21H3b2314
MFCD03299391
S=C1SC(=Cc2c(nc3n(c2=O)cccc3)N(Cc2ccccc2)C)C(=O)N1Cc1ccc2c(c1)OCO2
ZINC000100861851
ZINC100861851

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Available files

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