Vitas-M small molecule compound

(5Z)-5-{[1-(4-tert-butylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-3-ethyl-1,3-thiazolidine-2,4-dione

Catalog ID
STK155597
SMILES CCN1C(=O)S/C(=C\c2cc(n(c2C)c2ccc(cc2)C(C)(C)C)C)/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 C22H26N2O2S MW 382.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O2S/c1-7-23-20(25)19(27-21(23)26)13-16-12-14(2)24(15(16)3)18-10-8-17(9-11-18)22(4,5)6/h8-13H,7H2,1-6H3/b19-13-
InChIKey
OZTAVZLLLUVQMQ-UYRXBGFRSA-N
Synonyms

(5Z)5((1(4TERTBUTYLPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)3ETHYL13THIAZOLIDINE24DIONE
(5Z)5((1(4TERTBUTYLPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)3ETHYL13THIAZOLIDINE24DIONE
5((1(4(TERTBUTYL)PHENYL)25DIMETHYLPYRROL3YL)METHYLENE)3ETHYL13THIAZOLIDINE24DIONE
CCN1C(=O)C(=CC2=C(N(C(=C2)C)C3=CC=C(C=C3)C(C)(C)C)C)SC1=O
CCN1C(=O)SC(=Cc2cc(n(c2C)c2ccc(cc2)C(C)(C)C)C)C1=O
InChI=1SC22H26N2O2Sc172320(25)19(2721(23)26)13161214(2)24(15(16)3)1810817(91118)22(45)6h813H7H216H3b1913
MFCD04358261
ZINC000004107007
ZINC04107007
ZINC4107007

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Available files

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