Vitas-M small molecule compound
(4E)-5-(3-chlorophenyl)-4-(hydroxy{4-[(2-methylbenzyl)oxy]phenyl}methylidene)-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione
Catalog ID
STL150078
SMILES Clc1cccc(c1)C1N(c2nnc(s2)C)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OCc1ccccc1C)/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 C28H22ClN3O4S MW 532.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22ClN3O4S/c1-16-6-3-4-7-20(16)15-36-22-12-10-18(11-13-22)25(33)23-24(19-8-5-9-21(29)14-19)32(27(35)26(23)34)28-31-30-17(2)37-28/h3-14,24,33H,15H2,1-2H3/b25-23+InChIKey
JQASGVCHFAMTIU-WJTDDFOZSA-NSynonyms
843636-57-7(4E)5(3chlorophenyl)4(hydroxy(4((2methylbenzyl)oxy)phenyl)methylidene)1(5methyl134thiadiazol2yl)pyrrolidine23dione
(4E)5(3CHLOROPHENYL)4(HYDROXY(4((2METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)1(5METHYL134THIADIAZOL2YL)PYRROLIDINE23DIONE
843636577
CC1=CC=CC=C1COC2=CC=C(C=C2)C(=C3C(N(C(=O)C3=O)C4=NN=C(S4)C)C5=CC(=CC=C5)Cl)O
Clc1cccc(c1)C1N(c2nnc(s2)C)C(=O)C(=O)C1=C(c1ccc(cc1)OCc1ccccc1C)O
InChI=1SC28H22ClN3O4Sc116634720(16)153622121018(111322)25(33)2324(1985921(29)1419)32(27(35)26(23)34)28313017(2)3728h3142433H15H212H3b2523+
MFCD04076211
ZINC000102930827
ZINC000102930829
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