Vitas-M small molecule compound
4-{(5Z)-5-[(9-methyl-4-oxo-2-{[3-(propan-2-yloxy)propyl]amino}-4H-pyrido[1,2-a]pyrimidin-3-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}butanoic acid
Catalog ID
STK881408
SMILES OC(=O)CCCN1C(=S)S/C(=C\c2c(NCCCOC(C)C)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 C23H28N4O5S2 MW 504.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N4O5S2/c1-14(2)32-12-6-9-24-19-16(21(30)26-10-4-7-15(3)20(26)25-19)13-17-22(31)27(23(33)34-17)11-5-8-18(28)29/h4,7,10,13-14,24H,5-6,8-9,11-12H2,1-3H3,(H,28,29)/b17-13-InChIKey
LCZNRROFDMHSKV-LGMDPLHJSA-NSynonyms
799829-27-9(Z)4(5((2((3isopropoxypropyl)amino)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)4oxo2thioxothiazolidin3yl)butanoicacid
4((5Z)5((9methyl4oxo2((3(propan2yloxy)propyl)amino)4Hpyrido(12a)pyrimidin3yl)methylidene)4oxo2thioxo13thiazolidin3yl)butanoicacid
4((5Z)5((9METHYL4OXO2(3PROPAN2YLOXYPROPYLAMINO)PYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANOICACID
799829279
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CCCC(=O)O)NCCCOC(C)C
InChI=1SC23H28N4O5S2c114(2)321269241916(21(30)26104715(3)20(26)2519)131722(31)27(23(33)3417)115818(28)29h4710131424H56891112H213H3(H2829)b1713
MFCD03683915
OC(=O)CCCN1C(=S)SC(=Cc2c(NCCCOC(C)C)nc3n(c2=O)cccc3C)C1=O
ZINC000013689645
ZINC13689645
Check stock
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Check stock on Vitas-MAvailable files
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