Vitas-M small molecule compound

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

Catalog ID
STL363489
SMILES CCCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)C(=O)OCC)/C1=O

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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 C24H29N5O4S2 MW 515.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N5O4S2/c1-3-5-7-11-29-22(31)18(35-24(29)34)16-17-20(25-19-9-6-8-10-28(19)21(17)30)26-12-14-27(15-13-26)23(32)33-4-2/h6,8-10,16H,3-5,7,11-15H2,1-2H3/b18-16-
InChIKey
UKWPXXRBOXYJDQ-VLGSPTGOSA-N
Synonyms
607692-60-4
(Z)ethyl4(4oxo3((4oxo3pentyl2thioxothiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin2yl)piperazine1carboxylate
607692604
CCCCCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CCN(CC4)C(=O)OCC)SC1=S
CCCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3)N2CCN(CC2)C(=O)OCC)C1=O
ETHYL4(4OXO3((4OXO3PENTYL2THIOXO(13THIAZOLIDIN5YLIDENE))METHYL)5HYDROPYRIDINO(12A)PYRIMIDIN2YL)PIPERAZINECARBOXYLATE
ETHYL4(4OXO3((Z)(4OXO3PENTYL2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PYRIDO(12A)PYRIMIDIN2YL)PIPERAZINE1CARBOXYLATE
ethyl4(4oxo3((Z)(4oxo3pentyl2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin2yl)piperazine1carboxylate
InChI=1SC24H29N5O4S2c1357112922(31)18(3524(29)34)161720(25199681028(19)21(17)30)26121427(151326)23(32)3342h681016H3571115H212H3b1816
MFCD03666791
ZINC000008858379
ZINC8858379

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Available files

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