Vitas-M small molecule compound
2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-[(Z)-(3-ethyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK703206
SMILES CCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)Cc2ccc3c(c2)OCO3)/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 C26H25N5O4S2 MW 535.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N5O4S2/c1-2-30-25(33)21(37-26(30)36)14-18-23(27-22-5-3-4-8-31(22)24(18)32)29-11-9-28(10-12-29)15-17-6-7-19-20(13-17)35-16-34-19/h3-8,13-14H,2,9-12,15-16H2,1H3/b21-14-InChIKey
SSGRRTDGVZGNMF-STZFKDTASA-NSynonyms
608120-15-6(5Z)5((2(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3ETHYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3ethyl2thioxothiazolidin4one
2(4(13benzodioxol5ylmethyl)piperazin1yl)3((Z)(3ethyl4oxo2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
608120156
CCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CCN(CC4)CC5=CC6=C(C=C5)OCO6)SC1=S
CCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3)N2CCN(CC2)Cc2ccc3c(c2)OCO3)C1=O
InChI=1SC26H25N5O4S2c123025(33)21(3726(30)36)141823(2722534831(22)24(18)32)2911928(101229)1517671920(1317)35163419h381314H29121516H21H3b2114
MFCD03212892
ZINC000100762999
ZINC100762999
Check stock
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Check stock on Vitas-MAvailable files
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