Vitas-M small molecule compound
3-{(Z)-[3-(4-methoxybenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(octylamino)-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK881265
SMILES CCCCCCCCNc1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccc(cc1)OC
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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 C28H32N4O3S2 MW 536.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N4O3S2/c1-3-4-5-6-7-9-16-29-25-22(26(33)31-17-10-8-11-24(31)30-25)18-23-27(34)32(28(36)37-23)19-20-12-14-21(35-2)15-13-20/h8,10-15,17-18,29H,3-7,9,16,19H2,1-2H3/b23-18-InChIKey
UBKKSCZJYACUNB-NKFKGCMQSA-NSynonyms
608496-95-3(5Z)3((4METHOXYPHENYL)METHYL)5((2(OCTYLAMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(4methoxybenzyl)5((2(octylamino)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(4methoxybenzyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2(octylamino)4Hpyrido(12a)pyrimidin4one
608496953
CCCCCCCCNC1=C(C(=O)N2C=CC=CC2=N1)C=C3C(=O)N(C(=S)S3)CC4=CC=C(C=C4)OC
CCCCCCCCNc1nc2ccccn2c(=O)c1C=C1SC(=S)N(C1=O)Cc1ccc(cc1)OC
InChI=1SC28H32N4O3S2c134567916292522(26(33)31171081124(31)3025)182327(34)32(28(36)3723)1920121421(352)151320h81015171829H3791619H212H3b2318
MFCD03691079
ZINC000101015245
ZINC101015245
Check stock
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Check stock on Vitas-MAvailable files
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