Vitas-M small molecule compound
ethyl 1-(3-{(Z)-[3-(3-ethoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)piperidine-4-carboxylate
Catalog ID
STL336605
SMILES CCOCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCC(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 C25H30N4O5S2 MW 530.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N4O5S2/c1-3-33-15-7-12-29-23(31)19(36-25(29)35)16-18-21(26-20-8-5-6-11-28(20)22(18)30)27-13-9-17(10-14-27)24(32)34-4-2/h5-6,8,11,16-17H,3-4,7,9-10,12-15H2,1-2H3/b19-16-InChIKey
ILKGGINQQACXOT-MNDPQUGUSA-NSynonyms
615272-75-8(Z)ethyl1(3((3(3ethoxypropyl)4oxo2thioxothiazolidin5ylidene)methyl)4oxo4Hpyrido(12a)pyrimidin2yl)piperidine4carboxylate
615272758
CCOCCCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CCC(CC4)C(=O)OCC)SC1=S
CCOCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3)N2CCC(CC2)C(=O)OCC)C1=O
ETHYL1(3((3(3ETHOXYPROPYL)4OXO2THIOXO(13THIAZOLIDIN5YLIDENE))METHYL)4OXO5HYDROPYRIDINO(12A)PYRIMIDIN2YL)PIPERIDINE4CARBOXYLATE
ETHYL1(3((Z)(3(3ETHOXYPROPYL)4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)4OXOPYRIDO(12A)PYRIMIDIN2YL)PIPERIDINE4CARBOXYLATE
ethyl1(3((Z)(3(3ethoxypropyl)4oxo2thioxo13thiazolidin5ylidene)methyl)4oxo4Hpyrido(12a)pyrimidin2yl)piperidine4carboxylate
InChI=1SC25H30N4O5S2c1333157122923(31)19(3625(29)35)161821(26208561128(20)22(18)30)2713917(101427)24(32)3442h568111617H3479101215H212H3b1916
MFCD03667521
ZINC000100860973
ZINC100860973
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