Vitas-M small molecule compound
(4E)-4-[hydroxy(4-methylphenyl)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)-5-(3-methoxyphenyl)pyrrolidine-2,3-dione
Catalog ID
STK564392
SMILES COc1cccc(c1)C1N(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/c1-15-7-9-16(10-8-15)24(30)22-23(17-5-4-6-18(13-17)33-2)29(26(32)25(22)31)27-28-20-12-11-19(34-3)14-21(20)35-27/h4-14,23,30H,1-3H3/b24-22+InChIKey
MMXIKDJMJWANJY-ZNTNEXAZSA-NSynonyms
514186-76-6(4E)4(hydroxy(4methylphenyl)methylidene)1(6methoxy13benzothiazol2yl)5(3methoxyphenyl)pyrrolidine23dione
3HYDROXY1(6METHOXYBENZOTHIAZOL2YL)5(3METHOXYPHENYL)4((4METHYLPHENYL)CARBONYL)3PYRROLIN2ONE
514186766
CC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=NC4=C(S3)C=C(C=C4)OC)C5=CC(=CC=C5)OC)O
COc1cccc(c1)C1N(c2nc3c(s2)cc(cc3)OC)C(=O)C(=O)C1=C(c1ccc(cc1)C)O
InChI=1SC27H22N2O5Sc1157916(10815)24(30)2223(1754618(1317)332)29(26(32)25(22)31)272820121119(343)1421(20)3527h4142330H13H3b2422+
MFCD03802805
ZINC000102527588
ZINC000102527596
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