Vitas-M small molecule compound
7-methyl-3-[(Z)-(3-octyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-(phenylsulfanyl)-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK881591
SMILES CCCCCCCCN1C(=S)S/C(=C\c2c(Sc3ccccc3)nc3n(c2=O)cc(cc3)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 C27H29N3O2S3 MW 523.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O2S3/c1-3-4-5-6-7-11-16-29-26(32)22(35-27(29)33)17-21-24(34-20-12-9-8-10-13-20)28-23-15-14-19(2)18-30(23)25(21)31/h8-10,12-15,17-18H,3-7,11,16H2,1-2H3/b22-17-InChIKey
WQUBYHKKQFQYNF-XLNRJJMWSA-NSynonyms
799772-56-8(5Z)5((7METHYL4OXO2PHENYLSULFANYLPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3OCTYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((7methyl4oxo2(phenylthio)4Hpyrido(12a)pyrimidin3yl)methylene)3octyl2thioxothiazolidin4one
799772568
7methyl3((Z)(3octyl4oxo2thioxo13thiazolidin5ylidene)methyl)2(phenylsulfanyl)4Hpyrido(12a)pyrimidin4one
CCCCCCCCN1C(=O)C(=CC2=C(N=C3C=CC(=CN3C2=O)C)SC4=CC=CC=C4)SC1=S
CCCCCCCCN1C(=S)SC(=Cc2c(Sc3ccccc3)nc3n(c2=O)cc(cc3)C)C1=O
InChI=1SC27H29N3O2S3c13456711162926(32)22(3527(29)33)172124(34201298101320)2823151419(2)1830(23)25(21)31h81012151718H371116H212H3b2217
MFCD03212879
ZINC000100947713
ZINC100947713
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