Vitas-M small molecule compound
ethyl 4-(9-methyl-4-oxo-3-{(Z)-[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-2-yl)piperazine-1-carboxylate
Catalog ID
STK855678
SMILES C=CCN1C(=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 C23H25N5O4S2 MW 499.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N5O4S2/c1-4-8-28-21(30)17(34-23(28)33)14-16-19(24-18-15(3)7-6-9-27(18)20(16)29)25-10-12-26(13-11-25)22(31)32-5-2/h4,6-7,9,14H,1,5,8,10-13H2,2-3H3/b17-14-InChIKey
JZEXWRFRBMVPFK-VKAVYKQESA-NSynonyms
607692-86-4(Z)ethyl4(3((3allyl4oxo2thioxothiazolidin5ylidene)methyl)9methyl4oxo4Hpyrido(12a)pyrimidin2yl)piperazine1carboxylate
607692864
C=CCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3C)N2CCN(CC2)C(=O)OCC)C1=O
CCOC(=O)N1CCN(CC1)C2=C(C(=O)N3C=CC=C(C3=N2)C)C=C4C(=O)N(C(=S)S4)CC=C
ETHYL4(9METHYL4OXO3((4OXO3PROP2ENYL2THIOXO(13THIAZOLIDIN5YLIDENE))METHYL)5HYDROPYRIDINO(12A)PYRIMIDIN2YL)PIPERAZINECARBOXYLATE
ethyl4(9methyl4oxo3((Z)(4oxo3(prop2en1yl)2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin2yl)piperazine1carboxylate
ETHYL4(9METHYL4OXO3((Z)(4OXO3PROP2ENYL2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PYRIDO(12A)PYRIMIDIN2YL)PIPERAZINE1CARBOXYLATE
InChI=1SC23H25N5O4S2c1482821(30)17(3423(28)33)141619(241815(3)76927(18)20(16)29)25101226(131125)22(31)3252h467914H1581013H223H3b1714
MFCD03662864
ZINC000008858372
ZINC8858372
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