Vitas-M small molecule compound
3-[(Z)-(3-hexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-[(2-hydroxy-2-phenylethyl)amino]-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK707391
SMILES CCCCCCN1C(=S)S/C(=C\c2c(NCC(c3ccccc3)O)nc3n(c2=O)cccc3C)/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 C27H30N4O3S2 MW 522.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N4O3S2/c1-3-4-5-9-14-31-26(34)22(36-27(31)35)16-20-23(28-17-21(32)19-12-7-6-8-13-19)29-24-18(2)11-10-15-30(24)25(20)33/h6-8,10-13,15-16,21,28,32H,3-5,9,14,17H2,1-2H3/b22-16-InChIKey
BPNNRWAQPPGVET-JWGURIENSA-NSynonyms
849918-56-5(5Z)3HEXYL5((2((2HYDROXY2PHENYLETHYL)AMINO)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3hexyl5((2((2hydroxy2phenylethyl)amino)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3hexyl4oxo2thioxo13thiazolidin5ylidene)methyl)2((2hydroxy2phenylethyl)amino)9methyl4Hpyrido(12a)pyrimidin4one
849918565
CCCCCCN1C(=O)C(=CC2=C(N=C3C(=CC=CN3C2=O)C)NCC(C4=CC=CC=C4)O)SC1=S
CCCCCCN1C(=S)SC(=Cc2c(NCC(c3ccccc3)O)nc3n(c2=O)cccc3C)C1=O
InChI=1SC27H30N4O3S2c13459143126(34)22(3627(31)35)162023(281721(32)19127681319)292418(2)11101530(24)25(20)33h6810131516212832H3591417H212H3b2216
MFCD05689185
ZINC000013806127
ZINC000013806131
Check stock
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Check stock on Vitas-MAvailable files
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