Vitas-M small molecule compound
3-[(Z)-(3-cyclohexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-(3,4-dihydroisoquinolin-2(1H)-yl)-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK707203
SMILES S=C1S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCc3c(C2)cccc3)/C(=O)N1C1CCCCC1
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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 C28H28N4O2S2 MW 516.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N4O2S2/c1-18-8-7-14-31-24(18)29-25(30-15-13-19-9-5-6-10-20(19)17-30)22(26(31)33)16-23-27(34)32(28(35)36-23)21-11-3-2-4-12-21/h5-10,14,16,21H,2-4,11-13,15,17H2,1H3/b23-16-InChIKey
YVLWLYRDNMSAIN-KQWNVCNZSA-NSynonyms
840482-98-6(5Z)3CYCLOHEXYL5((2(34DIHYDRO1HISOQUINOLIN2YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3cyclohexyl5((2(34dihydroisoquinolin2(1H)yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3cyclohexyl4oxo2thioxo13thiazolidin5ylidene)methyl)2(34dihydroisoquinolin2(1H)yl)9methyl4Hpyrido(12a)pyrimidin4one
840482986
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)C4CCCCC4)N5CCC6=CC=CC=C6C5
InChI=1SC28H28N4O2S2c11887143124(18)2925(301513199561020(19)1730)22(26(31)33)162327(34)32(28(35)3623)21113241221h510141621H2411131517H21H3b2316
MFCD04007126
S=C1SC(=Cc2c(nc3n(c2=O)cccc3C)N2CCc3c(C2)cccc3)C(=O)N1C1CCCCC1
ZINC000002264373
ZINC2264373
Check stock
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Check stock on Vitas-MAvailable files
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