Vitas-M small molecule compound
(4E)-5-(3-chlorophenyl)-1-{5-[(2,4-dichlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Catalog ID
STK595927
SMILES CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Cl)c1nnc(s1)SCc1ccc(cc1Cl)Cl)/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 C29H20Cl3N3O4S2 MW 644.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H20Cl3N3O4S2/c1-14-9-18-10-16(6-8-22(18)39-14)25(36)23-24(15-3-2-4-19(30)11-15)35(27(38)26(23)37)28-33-34-29(41-28)40-13-17-5-7-20(31)12-21(17)32/h2-8,10-12,14,24,36H,9,13H2,1H3/b25-23+InChIKey
GKZPVEVDUNHMNT-WJTDDFOZSA-NSynonyms
1203348-79-1(4E)5(3chlorophenyl)1(5((24dichlorobenzyl)sulfanyl)134thiadiazol2yl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)pyrrolidine23dione
(4E)5(3chlorophenyl)1(5((24dichlorophenyl)methylsulfanyl)134thiadiazol2yl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)pyrrolidine23dione
1203348791
CC1CC2=C(O1)C=CC(=C2)C(=C3C(N(C(=O)C3=O)C4=NN=C(S4)SCC5=C(C=C(C=C5)Cl)Cl)C6=CC(=CC=C6)Cl)O
CC1Oc2c(C1)cc(cc2)C(=C1C(=O)C(=O)N(C1c1cccc(c1)Cl)c1nnc(s1)SCc1ccc(cc1Cl)Cl)O
InChI=1SC29H20Cl3N3O4S2c1149181016(6822(18)3914)25(36)2324(1532419(30)1115)35(27(38)26(23)37)28333429(4128)4013175720(31)1221(17)32h281012142436H913H21H3b2523+
MFCD07198593
ZINC000150484876
ZINC000150484879
Check stock
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Check stock on Vitas-MAvailable files
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