Vitas-M small molecule compound

3-{(Z)-[3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-{[2-(2-hydroxyethoxy)ethyl]amino}-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STL363496
SMILES OCCOCCNc1nc2ccc(cn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccc2c(c1)OCO2)C

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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 C25H24N4O6S2 MW 540.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O6S2/c1-15-2-5-21-27-22(26-6-8-33-9-7-30)17(23(31)28(21)12-15)11-20-24(32)29(25(36)37-20)13-16-3-4-18-19(10-16)35-14-34-18/h2-5,10-12,26,30H,6-9,13-14H2,1H3/b20-11-
InChIKey
IYEJBBFJYSITOB-JAIQZWGSSA-N
Synonyms
615279-05-5
(5Z)3(13BENZODIOXOL5YLMETHYL)5((2(2(2HYDROXYETHOXY)ETHYLAMINO)7METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(benzo(d)(13)dioxol5ylmethyl)5((2((2(2hydroxyethoxy)ethyl)amino)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(13benzodioxol5ylmethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2((2(2hydroxyethoxy)ethyl)amino)7methyl4Hpyrido(12a)pyrimidin4one
3(2HBENZO(34D)13DIOXOLAN5YLMETHYL)5((2((2(2HYDROXYETHOXY)ETHYL)AMINO)7METHYL4OXO(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)2THIOXO13THIAZOLIDIN4ONE
615279055
CC1=CN2C(=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CC4=CC5=C(C=C4)OCO5)NCCOCCO)C=C1
InChI=1SC25H24N4O6S2c11525212722(2668339730)17(23(31)28(21)1215)112024(32)29(25(36)3720)1316341819(1016)35143418h2510122630H691314H21H3b2011
MFCD03665679
OCCOCCNc1nc2ccc(cn2c(=O)c1C=C1SC(=S)N(C1=O)Cc1ccc2c(c1)OCO2)C
ZINC000100863861
ZINC100863861

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Available files

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