Vitas-M small molecule compound

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

Catalog ID
STK876669
SMILES CCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCNC(=O)C2CC(=O)OC)/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 C22H23N5O5S2 MW 501.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5O5S2/c1-3-8-27-21(31)15(34-22(27)33)11-13-18(24-16-6-4-5-9-26(16)20(13)30)25-10-7-23-19(29)14(25)12-17(28)32-2/h4-6,9,11,14H,3,7-8,10,12H2,1-2H3,(H,23,29)/b15-11-
InChIKey
NIEVXUREFZYKBX-PTNGSMBKSA-N
Synonyms
1037751-41-9
(Z)methyl2(3oxo1(4oxo3((4oxo3propyl2thioxothiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin2yl)piperazin2yl)acetate
1037751419
CCCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CCNC(=O)C4CC(=O)OC)SC1=S
CCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3)N2CCNC(=O)C2CC(=O)OC)C1=O
InChI=1SC22H23N5O5S2c1382721(31)15(3422(27)33)111318(2416645926(16)20(13)30)251072319(29)14(25)1217(28)322h4691114H3781012H212H3(H2329)b1511
methyl(3oxo1(4oxo3((Z)(4oxo3propyl2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin2yl)piperazin2yl)acetate
METHYL2(3OXO1(4OXO3((4OXO3PROPYL2THIOXO(13THIAZOLIDIN5YLIDENE))METHYL)(5HYDROPYRIDINO(12A)PYRIMIDIN2YL))PIPERAZIN2YL)ACETATE
METHYL2(3OXO1(4OXO3((Z)(4OXO3PROPYL2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PYRIDO(12A)PYRIMIDIN2YL)PIPERAZIN2YL)ACETATE
MFCD03290790
ZINC000002335998
ZINC000008858079

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Available files

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