Vitas-M small molecule compound

(4E)-5-(4-tert-butylphenyl)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione

Catalog ID
STK609692
SMILES CCc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)C(C)(C)C)/C(=C(/c2ccc(cc2)F)\O)/C(=O)C1=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 C30H27FN2O3S MW 514.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27FN2O3S/c1-5-17-6-15-22-23(16-17)37-29(32-22)33-25(18-7-11-20(12-8-18)30(2,3)4)24(27(35)28(33)36)26(34)19-9-13-21(31)14-10-19/h6-16,25,34H,5H2,1-4H3/b26-24+
InChIKey
PAYNYEPXUNPBGQ-SHHOIMCASA-N
Synonyms
618420-56-7
(4E)5(4tertbutylphenyl)1(6ethyl13benzothiazol2yl)4((4fluorophenyl)(hydroxy)methylidene)pyrrolidine23dione
(4E)5(4TERTBUTYLPHENYL)1(6ETHYL13BENZOTHIAZOL2YL)4((4FLUOROPHENYL)HYDROXYMETHYLIDENE)PYRROLIDINE23DIONE
5(4(TERTBUTYL)PHENYL)1(6ETHYLBENZOTHIAZOL2YL)4((4FLUOROPHENYL)CARBONYL)3HYDROXY3PYRROLIN2ONE
5(4TERTBUTYLPHENYL)1(6ETHYL13BENZOTHIAZOL2YL)4(4FLUOROBENZOYL)3HYDROXY15DIHYDRO2HPYRROL2ONE
618420567
CCC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC=C(C=C4)F)O)C(=O)C3=O)C5=CC=C(C=C5)C(C)(C)C
CCc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)C(C)(C)C)C(=C(c2ccc(cc2)F)O)C(=O)C1=O
InChI=1SC30H27FN2O3Sc15176152223(1617)3729(3222)3325(1871120(12818)30(23)4)24(27(35)28(33)36)26(34)1991321(31)141019h6162534H5H214H3b2624+
MFCD08731331
ZINC000102706160
ZINC000102706162

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Available files

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