Vitas-M small molecule compound
(4E)-1-(6-chloro-1,3-benzothiazol-2-yl)-5-(3,4-dichlorophenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]pyrrolidine-2,3-dione
Catalog ID
STL052134
SMILES Clc1ccc2c(c1)sc(n2)N1C(c2ccc(c(c2)Cl)Cl)/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C1=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 C26H15Cl3N2O5S MW 573.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H15Cl3N2O5S/c27-14-3-5-17-20(11-14)37-26(30-17)31-22(12-1-4-15(28)16(29)9-12)21(24(33)25(31)34)23(32)13-2-6-18-19(10-13)36-8-7-35-18/h1-6,9-11,22,32H,7-8H2/b23-21+InChIKey
WHZKVPIMTSBJRT-XTQSDGFTSA-NSynonyms
(4E)1(6chloro13benzothiazol2yl)5(34dichlorophenyl)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)pyrrolidine23dione
C1COC2=C(O1)C=CC(=C2)C(=C3C(N(C(=O)C3=O)C4=NC5=C(S4)C=C(C=C5)Cl)C6=CC(=C(C=C6)Cl)Cl)O
Clc1ccc2c(c1)sc(n2)N1C(c2ccc(c(c2)Cl)Cl)C(=C(c2ccc3c(c2)OCCO3)O)C(=O)C1=O
InChI=1SC26H15Cl3N2O5Sc2714351720(1114)3726(3017)3122(121415(28)16(29)912)21(24(33)25(31)34)23(32)13261819(1013)36873518h169112232H78H2b2321+
MFCD05733651
ZINC000102889932
ZINC000102889934
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