Vitas-M small molecule compound

3-[(5Z)-5-({2-[(2-methylpropyl)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
STL236897
SMILES CC(CNc1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCC(=O)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 C19H20N4O4S2 MW 432.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N4O4S2/c1-11(2)10-20-16-12(17(26)22-7-4-3-5-14(22)21-16)9-13-18(27)23(19(28)29-13)8-6-15(24)25/h3-5,7,9,11,20H,6,8,10H2,1-2H3,(H,24,25)/b13-9-
InChIKey
ZWSWHHHAYIBBFS-LCYFTJDESA-N
Synonyms
608496-76-0
(Z)3(5((2(isobutylamino)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)4oxo2thioxothiazolidin3yl)propanoicacid
3((5Z)5((2((2methylpropyl)amino)4oxo4Hpyrido(12a)pyrimidin3yl)methylidene)4oxo2thioxo13thiazolidin3yl)propanoicacid
3((5Z)5((2(2METHYLPROPYLAMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOICACID
608496760
CC(C)CNC1=C(C(=O)N2C=CC=CC2=N1)C=C3C(=O)N(C(=S)S3)CCC(=O)O
CC(CNc1nc2ccccn2c(=O)c1C=C1SC(=S)N(C1=O)CCC(=O)O)C
InChI=1SC19H20N4O4S2c111(2)10201612(17(26)22743514(22)2116)91318(27)23(19(28)2913)8615(24)25h35791120H6810H212H3(H2425)b139
MFCD03686012
ZINC000002247564
ZINC2247564

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Available files

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