Vitas-M small molecule compound
3-{(Z)-[3-(4-methoxybenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-7-methyl-2-(octylamino)-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK904249
SMILES CCCCCCCCNc1nc2ccc(cn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccc(cc1)OC)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 C29H34N4O3S2 MW 550.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N4O3S2/c1-4-5-6-7-8-9-16-30-26-23(27(34)32-18-20(2)10-15-25(32)31-26)17-24-28(35)33(29(37)38-24)19-21-11-13-22(36-3)14-12-21/h10-15,17-18,30H,4-9,16,19H2,1-3H3/b24-17-InChIKey
BWHZLDRSEBDHBI-ULJHMMPZSA-NSynonyms
(5Z)3((4METHOXYPHENYL)METHYL)5((7METHYL2(OCTYLAMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(4methoxybenzyl)5((7methyl2(octylamino)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(4methoxybenzyl)4oxo2thioxo13thiazolidin5ylidene)methyl)7methyl2(octylamino)4Hpyrido(12a)pyrimidin4one
CCCCCCCCNC1=C(C(=O)N2C=C(C=CC2=N1)C)C=C3C(=O)N(C(=S)S3)CC4=CC=C(C=C4)OC
CCCCCCCCNc1nc2ccc(cn2c(=O)c1C=C1SC(=S)N(C1=O)Cc1ccc(cc1)OC)C
InChI=1SC29H34N4O3S2c145678916302623(27(34)321820(2)101525(32)3126)172428(35)33(29(37)3824)1921111322(363)141221h1015171830H491619H213H3b2417
MFCD03689016
ZINC000097947306
ZINC97947306
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