Vitas-M small molecule compound
3-{(Z)-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(4-methylpiperazin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK811506
SMILES CCC(N1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)C)/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 C21H25N5O2S2 MW 443.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5O2S2/c1-4-14(2)26-20(28)16(30-21(26)29)13-15-18(24-11-9-23(3)10-12-24)22-17-7-5-6-8-25(17)19(15)27/h5-8,13-14H,4,9-12H2,1-3H3/b16-13-InChIKey
TWWWQUIRLAUPKB-SSZFMOIBSA-NSynonyms
489463-06-1(5Z)3BUTAN2YL5((2(4METHYLPIPERAZIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(secbutyl)5((2(4methylpiperazin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(butan2yl)4oxo2thioxo13thiazolidin5ylidene)methyl)2(4methylpiperazin1yl)4Hpyrido(12a)pyrimidin4one
489463061
CCC(C)N1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CCN(CC4)C)SC1=S
CCC(N1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3)N2CCN(CC2)C)C1=O)C
InChI=1SC21H25N5O2S2c1414(2)2620(28)16(3021(26)29)131518(2411923(3)101224)2217756825(17)19(15)27h581314H4912H213H3b1613
MFCD03297629
ZINC000002280323
ZINC000002280325
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