Vitas-M small molecule compound
2-(3,4-dihydroisoquinolin-2(1H)-yl)-3-{(Z)-[3-(4-methoxybenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK904895
SMILES COc1ccc(cc1)CN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCc3c(C2)cccc3)/C1=O
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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 C29H24N4O3S2 MW 540.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24N4O3S2/c1-36-22-11-9-19(10-12-22)17-33-28(35)24(38-29(33)37)16-23-26(30-25-8-4-5-14-32(25)27(23)34)31-15-13-20-6-2-3-7-21(20)18-31/h2-12,14,16H,13,15,17-18H2,1H3/b24-16-InChIKey
DLMHERIPCMJJOF-JLPGSUDCSA-NSynonyms
847377-71-3(5Z)5((2(34DIHYDRO1HISOQUINOLIN2YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3((4METHOXYPHENYL)METHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(34dihydroisoquinolin2(1H)yl)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3(4methoxybenzyl)2thioxothiazolidin4one
2(34dihydroisoquinolin2(1H)yl)3((Z)(3(4methoxybenzyl)4oxo2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
847377713
COC1=CC=C(C=C1)CN2C(=O)C(=CC3=C(N=C4C=CC=CN4C3=O)N5CCC6=CC=CC=C6C5)SC2=S
COc1ccc(cc1)CN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3)N2CCc3c(C2)cccc3)C1=O
InChI=1SC29H24N4O3S2c1362211919(101222)173328(35)24(3829(33)37)162326(30258451432(25)27(23)34)31151320623721(20)1831h2121416H13151718H21H3b2416
MFCD04181368
ZINC000101142641
ZINC101142641
Check stock
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Check stock on Vitas-MAvailable files
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