Vitas-M small molecule compound
2-[(2-hydroxy-2-phenylethyl)amino]-3-[(Z)-(4-oxo-3-propyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK554988
SMILES CCCN1C(=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 C23H22N4O3S2 MW 466.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O3S2/c1-2-11-27-22(30)18(32-23(27)31)13-16-20(24-14-17(28)15-8-4-3-5-9-15)25-19-10-6-7-12-26(19)21(16)29/h3-10,12-13,17,24,28H,2,11,14H2,1H3/b18-13-InChIKey
XZLHBKLWNJUWMF-AQTBWJFISA-NSynonyms
840496-01-7(5Z)5((2((2HYDROXY2PHENYLETHYL)AMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3PROPYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2((2hydroxy2phenylethyl)amino)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3propyl2thioxothiazolidin4one
2((2hydroxy2phenylethyl)amino)3((Z)(4oxo3propyl2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
840496017
CCCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)NCC(C4=CC=CC=C4)O)SC1=S
CCCN1C(=S)SC(=Cc2c(NCC(c3ccccc3)O)nc3n(c2=O)cccc3)C1=O
InChI=1SC23H22N4O3S2c12112722(30)18(3223(27)31)131620(241417(28)158435915)251910671226(19)21(16)29h3101213172428H21114H21H3b1813
MFCD04008098
ZINC000009463754
ZINC000009463756
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