Vitas-M small molecule compound
3-{(Z)-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-9-methyl-2-[(4-methylbenzyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK811989
SMILES CCC(N1C(=S)S/C(=C\c2c(NCc3ccc(cc3)C)nc3n(c2=O)cccc3C)/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 C25H26N4O2S2 MW 478.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O2S2/c1-5-17(4)29-24(31)20(33-25(29)32)13-19-21(26-14-18-10-8-15(2)9-11-18)27-22-16(3)7-6-12-28(22)23(19)30/h6-13,17,26H,5,14H2,1-4H3/b20-13-InChIKey
JZPCUWPKMREXAB-MOSHPQCFSA-NSynonyms
(5Z)3BUTAN2YL5((9METHYL2((4METHYLPHENYL)METHYLAMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
3((Z)(3(butan2yl)4oxo2thioxo13thiazolidin5ylidene)methyl)9methyl2((4methylbenzyl)amino)4Hpyrido(12a)pyrimidin4one
CCC(C)N1C(=O)C(=CC2=C(N=C3C(=CC=CN3C2=O)C)NCC4=CC=C(C=C4)C)SC1=S
CCC(N1C(=S)SC(=Cc2c(NCc3ccc(cc3)C)nc3n(c2=O)cccc3C)C1=O)C
InChI=1SC25H26N4O2S2c1517(4)2924(31)20(3325(29)32)131921(26141810815(2)91118)272216(3)761228(22)23(19)30h6131726H514H214H3b2013
MFCD03212706
ZINC000016713854
ZINC000016713856
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