Vitas-M small molecule compound
(4E)-5-(4-tert-butylphenyl)-4-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Catalog ID
STK607778
SMILES COc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C(C)(C)C)c1nc2c(s1)cc(cc2)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 C31H30N2O4S MW 526.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30N2O4S/c1-17-7-13-22-24(15-17)38-30(32-22)33-26(19-8-11-21(12-9-19)31(3,4)5)25(28(35)29(33)36)27(34)20-10-14-23(37-6)18(2)16-20/h7-16,26,34H,1-6H3/b27-25+InChIKey
QSRCBYXHVURPQA-IMVLJIQESA-NSynonyms
618416-74-3(4E)5(4tertbutylphenyl)4(hydroxy(4methoxy3methylphenyl)methylidene)1(6methyl13benzothiazol2yl)pyrrolidine23dione
5(4(TERTBUTYL)PHENYL)3HYDROXY4((4METHOXY3METHYLPHENYL)CARBONYL)1(6METHYLBENZOTHIAZOL2YL)3PYRROLIN2ONE
618416743
CC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC(=C(C=C4)OC)C)O)C(=O)C3=O)C5=CC=C(C=C5)C(C)(C)C
COc1ccc(cc1C)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)C(C)(C)C)c1nc2c(s1)cc(cc2)C)O
InChI=1SC31H30N2O4Sc1177132224(1517)3830(3222)3326(1981121(12919)31(34)5)25(28(35)29(33)36)27(34)20101423(376)18(2)1620h7162634H16H3b2725+
MFCD08733482
ZINC000102703335
ZINC000102703340
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