Vitas-M small molecule compound
3-[(Z)-(3-octyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-(pyrrolidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK819594
SMILES CCCCCCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCCC2)/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 C24H30N4O2S2 MW 470.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H30N4O2S2/c1-2-3-4-5-6-8-16-28-23(30)19(32-24(28)31)17-18-21(26-13-10-11-14-26)25-20-12-7-9-15-27(20)22(18)29/h7,9,12,15,17H,2-6,8,10-11,13-14,16H2,1H3/b19-17-InChIKey
HIIGAYJAIOFGLK-ZPHPHTNESA-NSynonyms
(5Z)3OCTYL5((4OXO2PYRROLIDIN1YLPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
3((Z)(3octyl4oxo2thioxo13thiazolidin5ylidene)methyl)2(pyrrolidin1yl)4Hpyrido(12a)pyrimidin4one
CCCCCCCCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CCCC4)SC1=S
CCCCCCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3)N2CCCC2)C1=O
InChI=1SC24H30N4O2S2c1234568162823(30)19(3224(28)31)171821(261310111426)252012791527(20)22(18)29h79121517H2681011131416H21H3b1917
MFCD04448503
ZINC000095927323
ZINC95927323
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