Vitas-M small molecule compound
(4E)-5-(3,4-dichlorophenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Catalog ID
STL040861
SMILES CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1ccc(c(c1)Cl)Cl)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 C28H20Cl2N2O4S MW 551.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20Cl2N2O4S/c1-13-3-7-20-22(9-13)37-28(31-20)32-24(15-4-6-18(29)19(30)12-15)23(26(34)27(32)35)25(33)16-5-8-21-17(11-16)10-14(2)36-21/h3-9,11-12,14,24,33H,10H2,1-2H3/b25-23+InChIKey
POKKWNQXRAOCJH-WJTDDFOZSA-NSynonyms
893699-19-9(4E)5(34dichlorophenyl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)1(6methyl13benzothiazol2yl)pyrrolidine23dione
893699199
CC1CC2=C(O1)C=CC(=C2)C(=C3C(N(C(=O)C3=O)C4=NC5=C(S4)C=C(C=C5)C)C6=CC(=C(C=C6)Cl)Cl)O
CC1Oc2c(C1)cc(cc2)C(=C1C(=O)C(=O)N(C1c1ccc(c(c1)Cl)Cl)c1nc2c(s1)cc(cc2)C)O
InChI=1SC28H20Cl2N2O4Sc113372022(913)3728(3120)3224(154618(29)19(30)1215)23(26(34)27(32)35)25(33)16582117(1116)1014(2)3621h391112142433H10H212H3b2523+
MFCD05737250
ZINC000102770792
ZINC000102770798
Check stock
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