Vitas-M small molecule compound
3-{(Z)-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-[(2-methoxyethyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK812453
SMILES COCCNc1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C(CC)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 C19H22N4O3S2 MW 418.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N4O3S2/c1-4-12(2)23-18(25)14(28-19(23)27)11-13-16(20-8-10-26-3)21-15-7-5-6-9-22(15)17(13)24/h5-7,9,11-12,20H,4,8,10H2,1-3H3/b14-11-InChIKey
KOPBXLFELLVUPP-KAMYIIQDSA-NSynonyms
(5Z)3BUTAN2YL5((2(2METHOXYETHYLAMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
3((Z)(3(butan2yl)4oxo2thioxo13thiazolidin5ylidene)methyl)2((2methoxyethyl)amino)4Hpyrido(12a)pyrimidin4one
CCC(C)N1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)NCCOC)SC1=S
COCCNc1nc2ccccn2c(=O)c1C=C1SC(=S)N(C1=O)C(CC)C
InChI=1SC19H22N4O3S2c1412(2)2318(25)14(2819(23)27)111316(20810263)2115756922(15)17(13)24h579111220H4810H213H3b1411
MFCD03933174
ZINC000002520583
ZINC000003652467
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