Vitas-M small molecule compound
(4E)-4-[hydroxy(4-methylphenyl)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)-5-(2-methoxyphenyl)pyrrolidine-2,3-dione
Catalog ID
STL150588
SMILES COc1ccccc1C1N(c2nc3c(s2)cc(cc3)OC)C(=O)C(=O)/C/1=C(\c1ccc(cc1)C)/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 C27H22N2O5S MW 486.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O5S/c1-15-8-10-16(11-9-15)24(30)22-23(18-6-4-5-7-20(18)34-3)29(26(32)25(22)31)27-28-19-13-12-17(33-2)14-21(19)35-27/h4-14,23,30H,1-3H3/b24-22+InChIKey
BWBQAFRJLJEDDB-ZNTNEXAZSA-NSynonyms
514186-75-5(4E)4(hydroxy(4methylphenyl)methylidene)1(6methoxy13benzothiazol2yl)5(2methoxyphenyl)pyrrolidine23dione
3HYDROXY1(6METHOXYBENZOTHIAZOL2YL)5(2METHOXYPHENYL)4((4METHYLPHENYL)CARBONYL)3PYRROLIN2ONE
514186755
CC1=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
COc1ccccc1C1N(c2nc3c(s2)cc(cc3)OC)C(=O)C(=O)C1=C(c1ccc(cc1)C)O
InChI=1SC27H22N2O5Sc11581016(11915)24(30)2223(18645720(18)343)29(26(32)25(22)31)272819131217(332)1421(19)3527h4142330H13H3b2422+
MFCD03800945
ZINC000102932216
ZINC000102932219
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