Vitas-M small molecule compound
2-[(2-hydroxy-2-phenylethyl)amino]-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
STK707099
SMILES COc1ccc(cc1)CN1C(=S)S/C(=C\c2c(NCC(c3ccccc3)O)nc3n(c2=O)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 C28H24N4O4S2 MW 544.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N4O4S2/c1-36-20-12-10-18(11-13-20)17-32-27(35)23(38-28(32)37)15-21-25(29-16-22(33)19-7-3-2-4-8-19)30-24-9-5-6-14-31(24)26(21)34/h2-15,22,29,33H,16-17H2,1H3/b23-15-InChIKey
DNSWNGGAYTVKRP-HAHDFKILSA-NSynonyms
573948-79-5(5Z)5((2((2HYDROXY2PHENYLETHYL)AMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3((4METHOXYPHENYL)METHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2((2hydroxy2phenylethyl)amino)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3(4methoxybenzyl)2thioxothiazolidin4one
2((2hydroxy2phenylethyl)amino)3((Z)(3(4methoxybenzyl)4oxo2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
573948795
COC1=CC=C(C=C1)CN2C(=O)C(=CC3=C(N=C4C=CC=CN4C3=O)NCC(C5=CC=CC=C5)O)SC2=S
COc1ccc(cc1)CN1C(=S)SC(=Cc2c(NCC(c3ccccc3)O)nc3n(c2=O)cccc3)C1=O
InChI=1SC28H24N4O4S2c13620121018(111320)173227(35)23(3828(32)37)152125(291622(33)197324819)30249561431(24)26(21)34h215222933H1617H21H3b2315
MFCD04021217
ZINC000101062086
ZINC000101062090
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.