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4-{(5Z)-5-[(2-{[3-(1H-imidazol-1-yl)propyl]amino}-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}butanoic acid

Catalog ID
STK794467
SMILES OC(=O)CCCN1C(=S)S/C(=C\c2c(NCCCn3cncc3)nc3n(c2=O)cccc3C)/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 C23H24N6O4S2 MW 512.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N6O4S2/c1-15-5-2-10-28-20(15)26-19(25-7-4-9-27-12-8-24-14-27)16(21(28)32)13-17-22(33)29(23(34)35-17)11-3-6-18(30)31/h2,5,8,10,12-14,25H,3-4,6-7,9,11H2,1H3,(H,30,31)/b17-13-
InChIKey
IJYHPQJRUDANQY-LGMDPLHJSA-N
Synonyms
469879-39-8
(Z)4(5((2((3(1Himidazol1yl)propyl)amino)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)4oxo2thioxothiazolidin3yl)butanoicacid
4((5Z)5((2((3(1Himidazol1yl)propyl)amino)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylidene)4oxo2thioxo13thiazolidin3yl)butanoicacid
4((5Z)5((2(3IMIDAZOL1YLPROPYLAMINO)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANOICACID
4(5((2((3(1HIMIDAZOL1YL)PROPYL)AMINO)9METHYL4OXO4HPYRIDO(12A)PYRIMIDIN3YL)METHYLENE)4OXO2THIOXOTHIAZOLIDIN3YL)BUTANOICACID
469879398
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CCCC(=O)O)NCCCN4C=CN=C4
InChI=1SC23H24N6O4S2c11552102820(15)2619(2574927128241427)16(21(28)32)131722(33)29(23(34)3517)113618(30)31h25810121425H3467911H21H3(H3031)b1713
MFCD03212223
OC(=O)CCCN1C(=S)SC(=Cc2c(NCCCn3cncc3)nc3n(c2=O)cccc3C)C1=O
ZINC000036006958
ZINC36006958

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Available files

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