Vitas-M small molecule compound

(4E)-4-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)-5-[4-(propan-2-yl)phenyl]pyrrolidine-2,3-dione

Catalog ID
STK631007
SMILES COc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)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 C30H28N2O4S MW 512.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28N2O4S/c1-16(2)19-7-9-20(10-8-19)26-25(27(33)21-11-13-23(36-5)18(4)15-21)28(34)29(35)32(26)30-31-22-12-6-17(3)14-24(22)37-30/h6-16,26,33H,1-5H3/b27-25+
InChIKey
DRBJGZSBPVAZOA-IMVLJIQESA-N
Synonyms
618416-69-6
(4E)4(hydroxy(4methoxy3methylphenyl)methylidene)1(6methyl13benzothiazol2yl)5(4(propan2yl)phenyl)pyrrolidine23dione
(4E)4(HYDROXY(4METHOXY3METHYLPHENYL)METHYLIDENE)1(6METHYL13BENZOTHIAZOL2YL)5(4PROPAN2YLPHENYL)PYRROLIDINE23DIONE
3HYDROXY4((4METHOXY3METHYLPHENYL)CARBONYL)1(6METHYLBENZOTHIAZOL2YL)5(4(METHYLETHYL)PHENYL)3PYRROLIN2ONE
618416696
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
COc1ccc(cc1C)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)C(C)C)c1nc2c(s1)cc(cc2)C)O
InChI=1SC30H28N2O4Sc116(2)197920(10819)2625(27(33)21111323(365)18(4)1521)28(34)29(35)32(26)30312212617(3)1424(22)3730h6162633H15H3b2725+
MFCD09793113
ZINC000102734517
ZINC000102734519

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Available files

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