Vitas-M small molecule compound
(4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-{5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-[3-(prop-2-en-1-yloxy)phenyl]pyrrolidine-2,3-dione
Catalog ID
STK589824
SMILES C=CCOc1cccc(c1)C1N(c2nnc(s2)SCc2cccc3c2cccc3)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/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 C35H27N3O6S2 MW 649.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H27N3O6S2/c1-2-15-42-25-11-6-9-22(18-25)30-29(31(39)23-13-14-27-28(19-23)44-17-16-43-27)32(40)33(41)38(30)34-36-37-35(46-34)45-20-24-10-5-8-21-7-3-4-12-26(21)24/h2-14,18-19,30,39H,1,15-17,20H2/b31-29+InChIKey
RMHLKELEGUMZCP-OWWNRXNESA-NSynonyms
618855-67-7(4E)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)1(5((naphthalen1ylmethyl)sulfanyl)134thiadiazol2yl)5(3(prop2en1yloxy)phenyl)pyrrolidine23dione
(4E)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)1(5(NAPHTHALEN1YLMETHYLSULFANYL)134THIADIAZOL2YL)5(3PROP2ENOXYPHENYL)PYRROLIDINE23DIONE
618855677
C=CCOC1=CC=CC(=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2C5=NN=C(S5)SCC6=CC=CC7=CC=CC=C76
C=CCOc1cccc(c1)C1N(c2nnc(s2)SCc2cccc3c2cccc3)C(=O)C(=O)C1=C(c1ccc2c(c1)OCCO2)O
InChI=1SC35H27N3O6S2c12154225116922(1825)3029(31(39)2313142728(1923)4417164327)32(40)33(41)38(30)34363735(4634)4520241058217341226(21)24h21418193039H1151720H2b3129+
MFCD07212293
ZINC000150480419
ZINC000150480422
Check stock
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Check stock on Vitas-MAvailable files
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