Vitas-M small molecule compound

ethyl 4-(3-{(Z)-[3-(3-methoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)piperazine-1-carboxylate

Catalog ID
STK606431
SMILES COCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)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 C24H29N5O5S2 MW 531.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N5O5S2/c1-4-34-23(32)27-12-10-26(11-13-27)20-17(21(30)28-8-5-7-16(2)19(28)25-20)15-18-22(31)29(24(35)36-18)9-6-14-33-3/h5,7-8,15H,4,6,9-14H2,1-3H3/b18-15-
InChIKey
IUIKQQOZVRQQJA-SDXDJHTJSA-N
Synonyms
607692-92-2
(Z)ethyl4(3((3(3methoxypropyl)4oxo2thioxothiazolidin5ylidene)methyl)9methyl4oxo4Hpyrido(12a)pyrimidin2yl)piperazine1carboxylate
607692922
CCOC(=O)N1CCN(CC1)C2=C(C(=O)N3C=CC=C(C3=N2)C)C=C4C(=O)N(C(=S)S4)CCCOC
COCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3C)N2CCN(CC2)C(=O)OCC)C1=O
ETHYL4(3((3(3METHOXYPROPYL)4OXO2THIOXO(13THIAZOLIDIN5YLIDENE))METHYL)9METHYL4OXO5HYDROPYRIDINO(12A)PYRIMIDIN2YL)PIPERAZINECARBOXYLATE
ETHYL4(3((Z)(3(3METHOXYPROPYL)4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN2YL)PIPERAZINE1CARBOXYLATE
ethyl4(3((Z)(3(3methoxypropyl)4oxo2thioxo13thiazolidin5ylidene)methyl)9methyl4oxo4Hpyrido(12a)pyrimidin2yl)piperazine1carboxylate
InChI=1SC24H29N5O5S2c143423(32)27121026(111327)2017(21(30)2885716(2)19(28)2520)151822(31)29(24(35)3618)9614333h57815H46914H213H3b1815
MFCD03666797
ZINC000100863826
ZINC100863826

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Available files

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