Vitas-M small molecule compound
3-{(Z)-[3-(1,1-dioxidotetrahydrothiophen-3-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(4-methoxyphenoxy)-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK905063
SMILES COc1ccc(cc1)Oc1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C1CCS(=O)(=O)C1
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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 C23H19N3O6S3 MW 529.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N3O6S3/c1-31-15-5-7-16(8-6-15)32-20-17(21(27)25-10-3-2-4-19(25)24-20)12-18-22(28)26(23(33)34-18)14-9-11-35(29,30)13-14/h2-8,10,12,14H,9,11,13H2,1H3/b18-12-InChIKey
ROZINMWMHBLQJR-PDGQHHTCSA-NSynonyms
(5Z)3(11dioxothiolan3yl)5((2(4methoxyphenoxy)4oxopyrido(12a)pyrimidin3yl)methylidene)2sulfanylidene13thiazolidin4one
3((Z)(3(11dioxidotetrahydrothiophen3yl)4oxo2thioxo13thiazolidin5ylidene)methyl)2(4methoxyphenoxy)4Hpyrido(12a)pyrimidin4one
COC1=CC=C(C=C1)OC2=C(C(=O)N3C=CC=CC3=N2)C=C4C(=O)N(C(=S)S4)C5CCS(=O)(=O)C5
COc1ccc(cc1)Oc1nc2ccccn2c(=O)c1C=C1SC(=S)N(C1=O)C1CCS(=O)(=O)C1
InChI=1SC23H19N3O6S3c131155716(8615)322017(21(27)251032419(25)2420)121822(28)26(23(33)3418)1491135(2930)1314h28101214H91113H21H3b1812
MFCD18076219
ZINC000097947374
ZINC000097947375
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