Vitas-M small molecule compound
2-(4-benzylpiperazin-1-yl)-7-methyl-3-{(Z)-[3-(3-methylbutyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STL363430
SMILES CC(CCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)Cc2ccccc2)/C1=O)C
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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 C29H33N5O2S2 MW 547.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33N5O2S2/c1-20(2)11-12-33-28(36)24(38-29(33)37)17-23-26(30-25-10-9-21(3)18-34(25)27(23)35)32-15-13-31(14-16-32)19-22-7-5-4-6-8-22/h4-10,17-18,20H,11-16,19H2,1-3H3/b24-17-InChIKey
LEHFEZNFGNYKHB-ULJHMMPZSA-NSynonyms
615275-64-4(5Z)5((2(4BENZYLPIPERAZIN1YL)7METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3(3METHYLBUTYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(4benzylpiperazin1yl)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3isopentyl2thioxothiazolidin4one
2(4benzylpiperazin1yl)7methyl3((Z)(3(3methylbutyl)4oxo2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
3(3METHYLBUTYL)5((7METHYL4OXO2(4BENZYLPIPERAZINYL)(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)2THIOXO13THIAZOLIDIN4ONE
615275644
CC(CCN1C(=S)SC(=Cc2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)Cc2ccccc2)C1=O)C
CC1=CN2C(=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CCC(C)C)N4CCN(CC4)CC5=CC=CC=C5)C=C1
InChI=1SC29H33N5O2S2c120(2)11123328(36)24(3829(33)37)172326(302510921(3)1834(25)27(23)35)32151331(141632)19227546822h410171820H111619H213H3b2417
MFCD03666535
ZINC000100863370
ZINC100863370
Check stock
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