Vitas-M small molecule compound
(4E)-5-(3-bromophenyl)-4-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Catalog ID
STK621931
SMILES COc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Br)c1nc2c(s1)cc(cc2)C)/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 C27H21BrN2O4S MW 549.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21BrN2O4S/c1-14-7-9-19-21(11-14)35-27(29-19)30-23(16-5-4-6-18(28)13-16)22(25(32)26(30)33)24(31)17-8-10-20(34-3)15(2)12-17/h4-13,23,31H,1-3H3/b24-22+InChIKey
BXOUXJGVUYHWIJ-ZNTNEXAZSA-NSynonyms
618416-94-7(4E)5(3bromophenyl)4(hydroxy(4methoxy3methylphenyl)methylidene)1(6methyl13benzothiazol2yl)pyrrolidine23dione
5(3BROMOPHENYL)3HYDROXY4((4METHOXY3METHYLPHENYL)CARBONYL)1(6METHYLBENZOTHIAZOL2YL)3PYRROLIN2ONE
5(3BROMOPHENYL)3HYDROXY4(4METHOXY3METHYLBENZOYL)1(6METHYL13BENZOTHIAZOL2YL)15DIHYDRO2HPYRROL2ONE
618416947
CC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC(=C(C=C4)OC)C)O)C(=O)C3=O)C5=CC(=CC=C5)Br
COc1ccc(cc1C)C(=C1C(=O)C(=O)N(C1c1cccc(c1)Br)c1nc2c(s1)cc(cc2)C)O
InChI=1SC27H21BrN2O4Sc114791921(1114)3527(2919)3023(1654618(28)1316)22(25(32)26(30)33)24(31)1781020(343)15(2)1217h4132331H13H3b2422+
MFCD09791518
ZINC000102722379
ZINC000102722385
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.