Vitas-M small molecule compound
3-[(5Z)-5-({2-[(2-hydroxy-2-phenylethyl)amino]-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}methylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoic acid
Catalog ID
STK707105
SMILES OC(=O)CCN1C(=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 C23H20N4O5S2 MW 496.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N4O5S2/c28-16(14-6-2-1-3-7-14)13-24-20-15(21(31)26-10-5-4-8-18(26)25-20)12-17-22(32)27(23(33)34-17)11-9-19(29)30/h1-8,10,12,16,24,28H,9,11,13H2,(H,29,30)/b17-12-InChIKey
PLIIZIOABSEIHJ-ATVHPVEESA-NSynonyms
575466-06-7(Z)3(5((2((2hydroxy2phenylethyl)amino)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)4oxo2thioxothiazolidin3yl)propanoicacid
3((5Z)5((2((2hydroxy2phenylethyl)amino)4oxo4Hpyrido(12a)pyrimidin3yl)methylidene)4oxo2thioxo13thiazolidin3yl)propanoicacid
3((5Z)5((2((2HYDROXY2PHENYLETHYL)AMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOICACID
575466067
C1=CC=C(C=C1)C(CNC2=C(C(=O)N3C=CC=CC3=N2)C=C4C(=O)N(C(=S)S4)CCC(=O)O)O
InChI=1SC23H20N4O5S2c2816(146213714)13242015(21(31)261054818(26)2520)121722(32)27(23(33)3417)11919(29)30h181012162428H91113H2(H2930)b1712
MFCD04026009
OC(=O)CCN1C(=S)SC(=Cc2c(NCC(c3ccccc3)O)nc3n(c2=O)cccc3)C1=O
ZINC000002375273
ZINC000013749343
Check stock
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Check stock on Vitas-MAvailable files
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