Vitas-M small molecule compound

2-(4-ethylpiperazin-1-yl)-7-methyl-3-{(Z)-[3-(4-methylbenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STK982886
SMILES CCN1CCN(CC1)c1nc2ccc(cn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccc(cc1)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 C27H29N5O2S2 MW 519.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O2S2/c1-4-29-11-13-30(14-12-29)24-21(25(33)31-16-19(3)7-10-23(31)28-24)15-22-26(34)32(27(35)36-22)17-20-8-5-18(2)6-9-20/h5-10,15-16H,4,11-14,17H2,1-3H3/b22-15-
InChIKey
ABUOKFAWPCTNEH-JCMHNJIXSA-N
Synonyms
487033-35-2
(5Z)5((2(4ETHYLPIPERAZIN1YL)7METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3((4METHYLPHENYL)METHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(4ethylpiperazin1yl)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3(4methylbenzyl)2thioxothiazolidin4one
2(4ethylpiperazin1yl)7methyl3((Z)(3(4methylbenzyl)4oxo2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
487033352
CCN1CCN(CC1)c1nc2ccc(cn2c(=O)c1C=C1SC(=S)N(C1=O)Cc1ccc(cc1)C)C
CCN1CCN(CC1)C2=C(C(=O)N3C=C(C=CC3=N2)C)C=C4C(=O)N(C(=S)S4)CC5=CC=C(C=C5)C
InChI=1SC27H29N5O2S2c1429111330(141229)2421(25(33)311619(3)71023(31)2824)152226(34)32(27(35)3622)17208518(2)6920h5101516H4111417H213H3b2215
MFCD03213022
ZINC000008858076
ZINC8858076

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Available files

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