Vitas-M small molecule compound

2-[4-(4-fluorophenyl)piperazin-1-yl]-3-{(Z)-[3-(2-methylpropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STK881221
SMILES CC(CN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)c2ccc(cc2)F)/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 C26H26FN5O2S2 MW 523.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26FN5O2S2/c1-17(2)16-32-25(34)21(36-26(32)35)15-20-23(28-22-5-3-4-10-31(22)24(20)33)30-13-11-29(12-14-30)19-8-6-18(27)7-9-19/h3-10,15,17H,11-14,16H2,1-2H3/b21-15-
InChIKey
AXOYTXFAIBTQFE-QNGOZBTKSA-N
Synonyms

(5Z)5((2(4(4FLUOROPHENYL)PIPERAZIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3(2METHYLPROPYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(E)5((2(4(4fluorophenyl)piperazin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3isobutyl2thioxothiazolidin4one
2(4(4fluorophenyl)piperazin1yl)3((Z)(3(2methylpropyl)4oxo2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
CC(C)CN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CCN(CC4)C5=CC=C(C=C5)F)SC1=S
CC(CN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3)N2CCN(CC2)c2ccc(cc2)F)C1=O)C
InChI=1SC26H26FN5O2S2c117(2)163225(34)21(3626(32)35)152023(28225341031(22)24(20)33)30131129(121430)198618(27)7919h3101517H111416H212H3b2115
MFCD18075895
ZINC000002247153
ZINC2247153

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Available files

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