Vitas-M small molecule compound

(5Z)-2-(pyrrolidin-1-yl)-5-(3,4,5-trimethoxybenzylidene)-1,3-thiazol-4(5H)-one

Catalog ID
STK795318
SMILES COc1cc(/C=C/2\SC(=NC2=O)N2CCCC2)cc(c1OC)OC

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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 C17H20N2O4S MW 348.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N2O4S/c1-21-12-8-11(9-13(22-2)15(12)23-3)10-14-16(20)18-17(24-14)19-6-4-5-7-19/h8-10H,4-7H2,1-3H3/b14-10-
InChIKey
BPAAVQUXYUXMDX-UVTDQMKNSA-N
Synonyms

(5Z)2(pyrrolidin1yl)5(345trimethoxybenzylidene)13thiazol4(5H)one
(5Z)2PYRROLIDIN1YL5((345TRIMETHOXYPHENYL)METHYLIDENE)13THIAZOL4ONE
2PYRROLIDIN1YL5(345TRIMETHOXYBENZYLIDENE)THIAZOL4ONE
COC1=CC(=CC(=C1OC)OC)C=C2C(=O)N=C(S2)N3CCCC3
COc1cc(C=C2SC(=NC2=O)N2CCCC2)cc(c1OC)OC
InChI=1SC17H20N2O4Sc12112811(913(222)15(12)233)101416(20)1817(2414)19645719h810H47H213H3b1410
MFCD01208683
ZINC000013634258
ZINC13634258

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Available files

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