Vitas-M small molecule compound

ethyl 1-{3-[(Z)-(3-cyclohexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}piperidine-4-carboxylate

Catalog ID
STL336160
SMILES CCOC(=O)C1CCN(CC1)c1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C1CCCCC1

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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 C26H30N4O4S2 MW 526.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N4O4S2/c1-2-34-25(33)17-11-14-28(15-12-17)22-19(23(31)29-13-7-6-10-21(29)27-22)16-20-24(32)30(26(35)36-20)18-8-4-3-5-9-18/h6-7,10,13,16-18H,2-5,8-9,11-12,14-15H2,1H3/b20-16-
InChIKey
CCWLENVKFFKUNY-SILNSSARSA-N
Synonyms
615272-89-4
(Z)ethyl1(3((3cyclohexyl4oxo2thioxothiazolidin5ylidene)methyl)4oxo4Hpyrido(12a)pyrimidin2yl)piperidine4carboxylate
615272894
CCOC(=O)C1CCN(CC1)c1nc2ccccn2c(=O)c1C=C1SC(=S)N(C1=O)C1CCCCC1
CCOC(=O)C1CCN(CC1)C2=C(C(=O)N3C=CC=CC3=N2)C=C4C(=O)N(C(=S)S4)C5CCCCC5
ETHYL1(3((3CYCLOHEXYL4OXO2THIOXO(13THIAZOLIDIN5YLIDENE))METHYL)4OXO5HYDROPYRIDINO(12A)PYRIMIDIN2YL)PIPERIDINE4CARBOXYLATE
ETHYL1(3((Z)(3CYCLOHEXYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)4OXOPYRIDO(12A)PYRIMIDIN2YL)PIPERIDINE4CARBOXYLATE
ethyl1(3((Z)(3cyclohexyl4oxo2thioxo13thiazolidin5ylidene)methyl)4oxo4Hpyrido(12a)pyrimidin2yl)piperidine4carboxylate
InChI=1SC26H30N4O4S2c123425(33)17111428(151217)2219(23(31)2913761021(29)2722)162024(32)30(26(35)3620)188435918h6710131618H258911121415H21H3b2016
MFCD03663797
ZINC000008857885
ZINC8857885

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Available files

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