Vitas-M small molecule compound
2-[(2-hydroxy-2-phenylethyl)amino]-3-[(Z)-(4-oxo-3-pentyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK707038
SMILES CCCCCN1C(=S)S/C(=C\c2c(NCC(c3ccccc3)O)nc3n(c2=O)cccc3)/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 C25H26N4O3S2 MW 494.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O3S2/c1-2-3-8-14-29-24(32)20(34-25(29)33)15-18-22(26-16-19(30)17-10-5-4-6-11-17)27-21-12-7-9-13-28(21)23(18)31/h4-7,9-13,15,19,26,30H,2-3,8,14,16H2,1H3/b20-15-InChIKey
AEKFCIVIJQKSEQ-HKWRFOASSA-NSynonyms
840511-56-0(5Z)5((2((2HYDROXY2PHENYLETHYL)AMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3PENTYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2((2hydroxy2phenylethyl)amino)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3pentyl2thioxothiazolidin4one
2((2hydroxy2phenylethyl)amino)3((Z)(4oxo3pentyl2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
840511560
CCCCCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)NCC(C4=CC=CC=C4)O)SC1=S
CCCCCN1C(=S)SC(=Cc2c(NCC(c3ccccc3)O)nc3n(c2=O)cccc3)C1=O
InChI=1SC25H26N4O3S2c1238142924(32)20(3425(29)33)151822(261619(30)17105461117)272112791328(21)23(18)31h4791315192630H2381416H21H3b2015
MFCD04009555
ZINC000013752254
ZINC000013752256
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