Vitas-M small molecule compound
2-(4-benzylpiperidin-1-yl)-3-{(Z)-[3-(3-ethoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK799339
SMILES CCOCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCC(CC2)Cc2ccccc2)/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 C30H34N4O3S2 MW 562.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34N4O3S2/c1-3-37-17-7-14-33-29(36)25(39-30(33)38)19-24-27(31-26-11-10-21(2)20-34(26)28(24)35)32-15-12-23(13-16-32)18-22-8-5-4-6-9-22/h4-6,8-11,19-20,23H,3,7,12-18H2,1-2H3/b25-19-InChIKey
GMYMBSPELIBDTD-PLRJNAJWSA-NSynonyms
(5Z)5((2(4BENZYLPIPERIDIN1YL)7METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3(3ETHOXYPROPYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(4benzylpiperidin1yl)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3(3ethoxypropyl)2thioxothiazolidin4one
2(4benzylpiperidin1yl)3((Z)(3(3ethoxypropyl)4oxo2thioxo13thiazolidin5ylidene)methyl)7methyl4Hpyrido(12a)pyrimidin4one
CCOCCCN1C(=O)C(=CC2=C(N=C3C=CC(=CN3C2=O)C)N4CCC(CC4)CC5=CC=CC=C5)SC1=S
CCOCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cc(cc3)C)N2CCC(CC2)Cc2ccccc2)C1=O
InChI=1SC30H34N4O3S2c1337177143329(36)25(3930(33)38)192427(3126111021(2)2034(26)28(24)35)32151223(131632)18228546922h46811192023H371218H212H3b2519
MFCD03462387
ZINC000097947513
ZINC97947513
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