Vitas-M small molecule compound
ethyl 4-{3-[(Z)-(3-cyclopentyl-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
STK609203
SMILES CCOC(=O)N1CCN(CC1)c1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C1CCCC1
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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 C25H29N5O4S2 MW 527.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N5O4S2/c1-3-34-24(33)28-13-11-27(12-14-28)21-18(22(31)29-10-6-7-16(2)20(29)26-21)15-19-23(32)30(25(35)36-19)17-8-4-5-9-17/h6-7,10,15,17H,3-5,8-9,11-14H2,1-2H3/b19-15-InChIKey
KNGZDANUJIAZOD-CYVLTUHYSA-NSynonyms
607694-39-3(Z)ethyl4(3((3cyclopentyl4oxo2thioxothiazolidin5ylidene)methyl)9methyl4oxo4Hpyrido(12a)pyrimidin2yl)piperazine1carboxylate
607694393
CCOC(=O)N1CCN(CC1)c1nc2c(C)cccn2c(=O)c1C=C1SC(=S)N(C1=O)C1CCCC1
CCOC(=O)N1CCN(CC1)C2=C(C(=O)N3C=CC=C(C3=N2)C)C=C4C(=O)N(C(=S)S4)C5CCCC5
ETHYL4(3((3CYCLOPENTYL4OXO2THIOXO(13THIAZOLIDIN5YLIDENE))METHYL)9METHYL4OXO5HYDROPYRIDINO(12A)PYRIMIDIN2YL)PIPERAZINECARBOXYLATE
ETHYL4(3((Z)(3CYCLOPENTYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN2YL)PIPERAZINE1CARBOXYLATE
ethyl4(3((Z)(3cyclopentyl4oxo2thioxo13thiazolidin5ylidene)methyl)9methyl4oxo4Hpyrido(12a)pyrimidin2yl)piperazine1carboxylate
InChI=1SC25H29N5O4S2c133424(33)28131127(121428)2118(22(31)29106716(2)20(29)2621)151923(32)30(25(35)3619)17845917h67101517H35891114H212H3b1915
MFCD03666694
ZINC000009165295
ZINC9165295
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