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3-[(5Z)-5-{[2-(dipropylamino)-7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoic acid

Catalog ID
STK707312
SMILES CCCN(c1nc2ccc(cn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCC(=O)O)C)CCC

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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 C22H26N4O4S2 MW 474.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4O4S2/c1-4-9-24(10-5-2)19-15(20(29)26-13-14(3)6-7-17(26)23-19)12-16-21(30)25(22(31)32-16)11-8-18(27)28/h6-7,12-13H,4-5,8-11H2,1-3H3,(H,27,28)/b16-12-
InChIKey
CCFBXZCZVXXMSW-VBKFSLOCSA-N
Synonyms
714234-97-6
(Z)3(5((2(dipropylamino)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)4oxo2thioxothiazolidin3yl)propanoicacid
3((5Z)5((2(dipropylamino)7methyl4oxo1Hpyrido(12a)pyrimidin5ium3yl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)propanoate
3((5Z)5((2(dipropylamino)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylidene)4oxo2thioxo13thiazolidin3yl)propanoicacid
3((5Z)5((2(DIPROPYLAMINO)7METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOICACID
714234976
CCCN(c1nc2ccc(cn2c(=O)c1C=C1SC(=S)N(C1=O)CCC(=O)O)C)CCC
CCCN(CCC)C1=C(C(=O)(N+)2=C(N1)C=CC(=C2)C)C=C3C(=O)N(C(=S)S3)CCC(=O)(O)
InChI=1SC22H26N4O4S2c14924(1052)1915(20(29)261314(3)6717(26)2319)121621(30)25(22(31)3216)11818(27)28h671213H45811H213H3(H2728)b1612
MFCD04157330
ZINC000001828245
ZINC01828245
ZINC1828245

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Available files

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