Vitas-M small molecule compound
(4E)-5-(3-ethoxy-4-hydroxyphenyl)-4-[hydroxy(3-methoxyphenyl)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Catalog ID
STK614567
SMILES CCOc1cc(ccc1O)C1/C(=C(/c2cccc(c2)OC)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)C
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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 C28H24N2O6S MW 516.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N2O6S/c1-4-36-21-14-16(9-11-20(21)31)24-23(25(32)17-6-5-7-18(13-17)35-3)26(33)27(34)30(24)28-29-19-10-8-15(2)12-22(19)37-28/h5-14,24,31-32H,4H2,1-3H3/b25-23+InChIKey
BTWRAVPBHDCFDL-WJTDDFOZSA-NSynonyms
607686-38-4(4E)5(3ethoxy4hydroxyphenyl)4(hydroxy(3methoxyphenyl)methylidene)1(6methyl13benzothiazol2yl)pyrrolidine23dione
607686384
CCOC1=C(C=CC(=C1)C2C(=C(C3=CC(=CC=C3)OC)O)C(=O)C(=O)N2C4=NC5=C(S4)C=C(C=C5)C)O
CCOc1cc(ccc1O)C1C(=C(c2cccc(c2)OC)O)C(=O)C(=O)N1c1sc2c(n1)ccc(c2)C
InChI=1SC28H24N2O6Sc1436211416(91120(21)31)2423(25(32)1765718(1317)353)26(33)27(34)30(24)28291910815(2)1222(19)3728h514243132H4H213H3b2523+
MFCD08734014
ZINC000102713128
ZINC000102713133
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