Vitas-M small molecule compound
(E)-[1-(6-bromo-1,3-benzothiazol-3-ium-2-yl)-2-(2-fluorophenyl)-4,5-dioxopyrrolidin-3-ylidene](phenyl)methanolate
Catalog ID
STL148375
SMILES Brc1ccc2c(c1)sc([nH+]2)N1C(=O)C(=O)/C(=C(\c2ccccc2)/[O-])/C1c1ccccc1F
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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 C24H14BrFN2O3S MW 509.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H14BrFN2O3S/c25-14-10-11-17-18(12-14)32-24(27-17)28-20(15-8-4-5-9-16(15)26)19(22(30)23(28)31)21(29)13-6-2-1-3-7-13/h1-12,20,29H/b21-19+InChIKey
DEBLTMZBYLFYNN-XUTLUUPISA-NSynonyms
371929-16-7(4E)1(6BROMO13BENZOTHIAZOL2YL)5(2FLUOROPHENYL)4(HYDROXY(PHENYL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(1(6bromo13benzothiazol3ium2yl)2(2fluorophenyl)45dioxopyrrolidin3ylidene)(phenyl)methanolate
371929167
Brc1ccc2c(c1)sc((nH+)2)N1C(=O)C(=O)C(=C(c2ccccc2)(O))C1c1ccccc1F
C1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=NC4=C(S3)C=C(C=C4)Br)C5=CC=CC=C5F)O
InChI=1SC24H14BrFN2O3Sc251410111718(1214)3224(2717)2820(15845916(15)26)19(22(30)23(28)31)21(29)136213713h1122029Hb2119+
MFCD20755385
ZINC000101095604
ZINC000101095607
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