Vitas-M small molecule compound
3-{(Z)-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-[4-(2-fluorophenyl)piperazin-1-yl]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK595169
SMILES CCC(N1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccccc2F)/C1=O)C
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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 C27H28FN5O2S2 MW 537.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28FN5O2S2/c1-4-18(3)33-26(35)22(37-27(33)36)15-19-24(29-23-10-9-17(2)16-32(23)25(19)34)31-13-11-30(12-14-31)21-8-6-5-7-20(21)28/h5-10,15-16,18H,4,11-14H2,1-3H3/b22-15-InChIKey
CQWNMVTZCRHLSH-JCMHNJIXSA-NSynonyms
617675-49-7(5Z)3BUTAN2YL5((2(4(2FLUOROPHENYL)PIPERAZIN1YL)7METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(secbutyl)5((2(4(2fluorophenyl)piperazin1yl)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(butan2yl)4oxo2thioxo13thiazolidin5ylidene)methyl)2(4(2fluorophenyl)piperazin1yl)7methyl4Hpyrido(12a)pyrimidin4one
5((2(4(2FLUOROPHENYL)PIPERAZINYL)7METHYL4OXO(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)3(METHYLPROPYL)2THIOXO13THIAZOLIDIN4ONE
617675497
CCC(C)N1C(=O)C(=CC2=C(N=C3C=CC(=CN3C2=O)C)N4CCN(CC4)C5=CC=CC=C5F)SC1=S
CCC(N1C(=S)SC(=Cc2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccccc2F)C1=O)C
InChI=1SC27H28FN5O2S2c1418(3)3326(35)22(3727(33)36)151924(292310917(2)1632(23)25(19)34)31131130(121431)21865720(21)28h510151618H41114H213H3b2215
MFCD03663885
ZINC000002367871
ZINC000002367875
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