Vitas-M small molecule compound
(1Z)-8-fluoro-4,4,6-trimethyl-1-[4-oxo-3-(prop-2-yn-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]-6-phenyl-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-one
Catalog ID
STL583201
SMILES C#CCN1C(=S)S/C(=C/2\C(=O)N3c4c2cc(F)cc4C(CC3(C)C)(C)c2ccccc2)/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 C26H21FN2O2S2 MW 476.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21FN2O2S2/c1-5-11-28-23(31)21(33-24(28)32)19-17-12-16(27)13-18-20(17)29(22(19)30)25(2,3)14-26(18,4)15-9-7-6-8-10-15/h1,6-10,12-13H,11,14H2,2-4H3/b21-19-InChIKey
LLHMWGGYCYWLHX-VZCXRCSSSA-NSynonyms
(1Z)8fluoro446trimethyl1(4oxo3(prop2yn1yl)2thioxo13thiazolidin5ylidene)6phenyl56dihydro4Hpyrrolo(321ij)quinolin2(1H)one
InChI=1SC26H21FN2O2S2c15112823(31)21(3324(28)32)19171216(27)131820(17)29(22(19)30)25(23)1426(184)1597681015h16101213H1114H224H3b2119
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