Vitas-M small molecule compound

(5E)-5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1,3-thiazolidine-2,4-dione

Catalog ID
STK130824
SMILES O=C(N1CCCC1)CN1C(=O)S/C(=C/c2cc(n(c2C)c2ccccc2)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 C22H23N3O3S MW 409.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O3S/c1-15-12-17(16(2)25(15)18-8-4-3-5-9-18)13-19-21(27)24(22(28)29-19)14-20(26)23-10-6-7-11-23/h3-5,8-9,12-13H,6-7,10-11,14H2,1-2H3/b19-13+
InChIKey
KVQSIVMZLNFQLK-CPNJWEJPSA-N
Synonyms

(5E)5((25DIMETHYL1PHENYL1HPYRROL3YL)METHYLIDENE)3(2OXO2(PYRROLIDIN1YL)ETHYL)13THIAZOLIDINE24DIONE
(5E)5((25DIMETHYL1PHENYLPYRROL3YL)METHYLIDENE)3(2OXO2PYRROLIDIN1YLETHYL)13THIAZOLIDINE24DIONE
CC1=CC(=C(N1C2=CC=CC=C2)C)C=C3C(=O)N(C(=O)S3)CC(=O)N4CCCC4
InChI=1SC22H23N3O3Sc1151217(16(2)25(15)188435918)131921(27)24(22(28)2919)1420(26)2310671123h35891213H67101114H212H3b1913+
MFCD04309301
O=C(N1CCCC1)CN1C(=O)SC(=Cc2cc(n(c2C)c2ccccc2)C)C1=O
ZINC000004677060
ZINC04677060
ZINC4677060

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Available files

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