Vitas-M small molecule compound

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

Catalog ID
STL148755
SMILES COc1ccc(cc1)/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 C29H26N2O4S MW 498.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N2O4S/c1-16(2)18-6-8-19(9-7-18)25-24(26(32)20-10-12-21(35-4)13-11-20)27(33)28(34)31(25)29-30-22-14-5-17(3)15-23(22)36-29/h5-16,25,32H,1-4H3/b26-24+
InChIKey
TZBMFUGSWITDRK-SHHOIMCASA-N
Synonyms
514189-32-3
(4E)4(hydroxy(4methoxyphenyl)methylidene)1(6methyl13benzothiazol2yl)5(4(propan2yl)phenyl)pyrrolidine23dione
(4E)4(HYDROXY(4METHOXYPHENYL)METHYLIDENE)1(6METHYL13BENZOTHIAZOL2YL)5(4PROPAN2YLPHENYL)PYRROLIDINE23DIONE
3HYDROXY4((4METHOXYPHENYL)CARBONYL)1(6METHYLBENZOTHIAZOL2YL)5(4(METHYLETHYL)PHENYL)3PYRROLIN2ONE
514189323
CC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC=C(C=C4)OC)O)C(=O)C3=O)C5=CC=C(C=C5)C(C)C
COc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)C(C)C)c1nc2c(s1)cc(cc2)C)O
InChI=1SC29H26N2O4Sc116(2)186819(9718)2524(26(32)20101221(354)131120)27(33)28(34)31(25)29302214517(3)1523(22)3629h5162532H14H3b2624+
MFCD03796223
ZINC000102927210
ZINC000102927214

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Available files

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