Vitas-M small molecule compound
(1Z)-8-fluoro-4,4-dimethyl-1-(4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-6-[(4-phenylpiperazin-1-yl)methyl]-4H-pyrrolo[3,2,1-ij]quinolin-2(1H)-one
Catalog ID
STL510625
SMILES S=C1NC(=O)/C(=C\2/C(=O)N3c4c2cc(F)cc4C(=CC3(C)C)CN2CCN(CC2)c2ccccc2)/S1
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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 C27H25FN4O2S2 MW 520.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25FN4O2S2/c1-27(2)14-16(15-30-8-10-31(11-9-30)18-6-4-3-5-7-18)19-12-17(28)13-20-21(25(34)32(27)22(19)20)23-24(33)29-26(35)36-23/h3-7,12-14H,8-11,15H2,1-2H3,(H,29,33,35)/b23-21-InChIKey
UHHRZZNLPKOXGR-LNVKXUELSA-NSynonyms
(1Z)8fluoro44dimethyl1(4oxo2thioxo13thiazolidin5ylidene)6((4phenylpiperazin1yl)methyl)4Hpyrrolo(321ij)quinolin2(1H)one
(5~(Z))5(6fluoro1111dimethyl2oxo9((4phenylpiperazin1yl)methyl)1azatricyclo(6310^(412))dodeca468(12)9tetraen3ylidene)2sulfanylidene13thiazolidin4one
134717268
InChI=1SC27H25FN4O2S2c127(2)1416(153081031(11930)186435718)191217(28)132021(25(34)32(27)22(19)20)2324(33)2926(35)3623h371214H81115H212H3(H293335)b2321
MFCD31711574
ZINC001554503293
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