Vitas-M small molecule compound
3-[(5Z)-5-({2-[(furan-2-ylmethyl)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
STK794474
SMILES OC(=O)CCN1C(=S)S/C(=C\c2c(NCc3ccco3)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 C20H16N4O5S2 MW 456.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N4O5S2/c25-16(26)6-8-24-19(28)14(31-20(24)30)10-13-17(21-11-12-4-3-9-29-12)22-15-5-1-2-7-23(15)18(13)27/h1-5,7,9-10,21H,6,8,11H2,(H,25,26)/b14-10-InChIKey
MFJJRJNEMHEZFX-UVTDQMKNSA-NSynonyms
431997-50-1(Z)3(5((2((furan2ylmethyl)amino)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)4oxo2thioxothiazolidin3yl)propanoicacid
3((5Z)5((2((furan2ylmethyl)amino)4oxo4Hpyrido(12a)pyrimidin3yl)methylidene)4oxo2thioxo13thiazolidin3yl)propanoicacid
3((5Z)5((2(FURAN2YLMETHYLAMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOICACID
431997501
C1=CC2=NC(=C(C(=O)N2C=C1)C=C3C(=O)N(C(=S)S3)CCC(=O)O)NCC4=CC=CO4
InChI=1SC20H16N4O5S2c2516(26)682419(28)14(3120(24)30)101317(2111124392912)2215512723(15)18(13)27h15791021H6811H2(H2526)b1410
MFCD03141464
OC(=O)CCN1C(=S)SC(=Cc2c(NCc3ccco3)nc3n(c2=O)cccc3)C1=O
ZINC000002349517
ZINC2349517
Check stock
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Check stock on Vitas-MAvailable files
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