Vitas-M small molecule compound
4-[(5Z)-5-({2-[benzyl(methyl)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
STK811447
SMILES OC(=O)CCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N(Cc2ccccc2)C)/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 C25H24N4O4S2 MW 508.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O4S2/c1-16-8-6-12-28-21(16)26-22(27(2)15-17-9-4-3-5-10-17)18(23(28)32)14-19-24(33)29(25(34)35-19)13-7-11-20(30)31/h3-6,8-10,12,14H,7,11,13,15H2,1-2H3,(H,30,31)/b19-14-InChIKey
IGUNCZKJYARFDY-RGEXLXHISA-NSynonyms
4((5Z)5((2(benzyl(methyl)amino)9methyl4oxo1Hpyrido(12a)pyrimidin5ium3yl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)butanoate
4((5Z)5((2(benzyl(methyl)amino)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylidene)4oxo2thioxo13thiazolidin3yl)butanoicacid
4((5Z)5((2(BENZYL(METHYL)AMINO)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANOICACID
CC1=C2NC(=C(C(=O)(N+)2=CC=C1)C=C3C(=O)N(C(=S)S3)CCCC(=O)(O))N(C)CC4=CC=CC=C4
InChI=1SC25H24N4O4S2c11686122821(16)2622(27(2)151794351017)18(23(28)32)141924(33)29(25(34)3519)1371120(30)31h368101214H7111315H212H3(H3031)b1914
MFCD03496091
OC(=O)CCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3C)N(Cc2ccccc2)C)C1=O
ZINC000002508685
ZINC02508685
ZINC2508685
Check stock
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Check stock on Vitas-MAvailable files
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