Vitas-M small molecule compound
(4E)-5-(4-tert-butylphenyl)-1-(6-fluoro-1,3-benzothiazol-2-yl)-4-[hydroxy(phenyl)methylidene]pyrrolidine-2,3-dione
Catalog ID
STL044992
SMILES Fc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1ccc(cc1)C(C)(C)C
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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 C28H23FN2O3S MW 486.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23FN2O3S/c1-28(2,3)18-11-9-16(10-12-18)23-22(24(32)17-7-5-4-6-8-17)25(33)26(34)31(23)27-30-20-14-13-19(29)15-21(20)35-27/h4-15,23,32H,1-3H3/b24-22+InChIKey
PXUAHBBIWOIATJ-ZNTNEXAZSA-NSynonyms
514189-83-4(4E)5(4tertbutylphenyl)1(6fluoro13benzothiazol2yl)4(hydroxy(phenyl)methylidene)pyrrolidine23dione
5(4(TERTBUTYL)PHENYL)1(6FLUOROBENZOTHIAZOL2YL)3HYDROXY4(PHENYLCARBONYL)3PYRROLIN2ONE
514189834
CC(C)(C)C1=CC=C(C=C1)C2C(=C(C3=CC=CC=C3)O)C(=O)C(=O)N2C4=NC5=C(S4)C=C(C=C5)F
Fc1ccc2c(c1)sc(n2)N1C(=O)C(=O)C(=C(c2ccccc2)O)C1c1ccc(cc1)C(C)(C)C
InChI=1SC28H23FN2O3Sc128(23)1811916(101218)2322(24(32)177546817)25(33)26(34)31(23)273020141319(29)1521(20)3527h4152332H13H3b2422+
MFCD03795724
ZINC000102877229
ZINC000102877232
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