Vitas-M small molecule compound
2-(3,4-dihydroisoquinolin-2(1H)-yl)-9-methyl-3-{(Z)-[4-oxo-3-(propan-2-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK556377
SMILES CC(N1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCc3c(C2)cccc3)/C1=O)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 C25H24N4O2S2 MW 476.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O2S2/c1-15(2)29-24(31)20(33-25(29)32)13-19-22(26-21-16(3)7-6-11-28(21)23(19)30)27-12-10-17-8-4-5-9-18(17)14-27/h4-9,11,13,15H,10,12,14H2,1-3H3/b20-13-InChIKey
GBMSLAGJFLHLBA-MOSHPQCFSA-NSynonyms
573694-72-1(5Z)5((2(34DIHYDRO1HISOQUINOLIN2YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3PROPAN2YL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(34dihydroisoquinolin2(1H)yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3isopropyl2thioxothiazolidin4one
2(34dihydroisoquinolin2(1H)yl)9methyl3((Z)(4oxo3(propan2yl)2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
573694721
CC(N1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3C)N2CCc3c(C2)cccc3)C1=O)C
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)C(C)C)N4CCC5=CC=CC=C5C4
InChI=1SC25H24N4O2S2c115(2)2924(31)20(3325(29)32)131922(262116(3)761128(21)23(19)30)27121017845918(17)1427h49111315H101214H213H3b2013
MFCD04017566
ZINC000002366558
ZINC2366558
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.