Vitas-M small molecule compound
2-[4-(2-fluorophenyl)piperazin-1-yl]-3-{(Z)-[3-(3-methoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK570176
SMILES COCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccccc2F)/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 C27H28FN5O3S2 MW 553.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28FN5O3S2/c1-18-8-9-23-29-24(31-13-11-30(12-14-31)21-7-4-3-6-20(21)28)19(25(34)33(23)17-18)16-22-26(35)32(27(37)38-22)10-5-15-36-2/h3-4,6-9,16-17H,5,10-15H2,1-2H3/b22-16-InChIKey
OQYXKCRVRIWMKU-JWGURIENSA-NSynonyms
(5Z)5((2(4(2FLUOROPHENYL)PIPERAZIN1YL)7METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3(3METHOXYPROPYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(4(2fluorophenyl)piperazin1yl)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3(3methoxypropyl)2thioxothiazolidin4one
2(4(2fluorophenyl)piperazin1yl)3((Z)(3(3methoxypropyl)4oxo2thioxo13thiazolidin5ylidene)methyl)7methyl4Hpyrido(12a)pyrimidin4one
CC1=CN2C(=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CCCOC)N4CCN(CC4)C5=CC=CC=C5F)C=C1
COCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccccc2F)C1=O
InChI=1SC27H28FN5O3S2c11889232924(31131130(121431)21743620(21)28)19(25(34)33(23)1718)162226(35)32(27(37)3822)10515362h34691617H51015H212H3b2216
MFCD03668253
ZINC000097965929
ZINC97965929
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