Vitas-M small molecule compound

2-[4-(3-chlorophenyl)piperazin-1-yl]-9-methyl-3-{(Z)-[4-oxo-3-(propan-2-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STK987973
SMILES Clc1cccc(c1)N1CCN(CC1)c1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C(C)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 C26H26ClN5O2S2 MW 540.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26ClN5O2S2/c1-16(2)32-25(34)21(36-26(32)35)15-20-23(28-22-17(3)6-5-9-31(22)24(20)33)30-12-10-29(11-13-30)19-8-4-7-18(27)14-19/h4-9,14-16H,10-13H2,1-3H3/b21-15-
InChIKey
JIYAHHZAXHAOBH-QNGOZBTKSA-N
Synonyms
385394-03-6
(5Z)5((2(4(3CHLOROPHENYL)PIPERAZIN1YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3PROPAN2YL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(4(3chlorophenyl)piperazin1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3isopropyl2thioxothiazolidin4one
2(4(3chlorophenyl)piperazin1yl)9methyl3((Z)(4oxo3(propan2yl)2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
385394036
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)C(C)C)N4CCN(CC4)C5=CC(=CC=C5)Cl
Clc1cccc(c1)N1CCN(CC1)c1nc2c(C)cccn2c(=O)c1C=C1SC(=S)N(C1=O)C(C)C
InChI=1SC26H26ClN5O2S2c116(2)3225(34)21(3626(32)35)152023(282217(3)65931(22)24(20)33)30121029(111330)1984718(27)1419h491416H1013H213H3b2115
MFCD03285866
ZINC000002320340
ZINC2320340

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Available files

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