Vitas-M small molecule compound
(4E)-4-[hydroxy(4-methoxyphenyl)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)-5-(2-methoxyphenyl)pyrrolidine-2,3-dione
Catalog ID
STL045367
SMILES COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1OC)c1nc2c(s1)cc(cc2)OC)/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 C27H22N2O6S MW 502.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O6S/c1-33-16-10-8-15(9-11-16)24(30)22-23(18-6-4-5-7-20(18)35-3)29(26(32)25(22)31)27-28-19-13-12-17(34-2)14-21(19)36-27/h4-14,23,30H,1-3H3/b24-22+InChIKey
QZECBDKASQVCTN-ZNTNEXAZSA-NSynonyms
514187-24-7(4E)4(hydroxy(4methoxyphenyl)methylidene)1(6methoxy13benzothiazol2yl)5(2methoxyphenyl)pyrrolidine23dione
3HYDROXY1(6METHOXYBENZOTHIAZOL2YL)5(2METHOXYPHENYL)4((4METHOXYPHENYL)CARBONYL)3PYRROLIN2ONE
514187247
COC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=NC4=C(S3)C=C(C=C4)OC)C5=CC=CC=C5OC)O
COc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccccc1OC)c1nc2c(s1)cc(cc2)OC)O
InChI=1SC27H22N2O6Sc1331610815(91116)24(30)2223(18645720(18)353)29(26(32)25(22)31)272819131217(342)1421(19)3627h4142330H13H3b2422+
MFCD03816498
ZINC000102877658
ZINC000102877660
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