Vitas-M small molecule compound
(5Z)-5-{3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxybenzylidene}-2-(phenylamino)-1,3-thiazol-4(5H)-one
Catalog ID
STK409744
SMILES COc1ccc(cc1Cn1nc(c(c1C)Br)C)/C=C/1\SC(=NC1=O)Nc1ccccc1
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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 C23H21BrN4O2S MW 497.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21BrN4O2S/c1-14-21(24)15(2)28(27-14)13-17-11-16(9-10-19(17)30-3)12-20-22(29)26-23(31-20)25-18-7-5-4-6-8-18/h4-12H,13H2,1-3H3,(H,25,26,29)/b20-12-InChIKey
UYPCBNSQLJXMOU-NDENLUEZSA-NSynonyms
(5Z)2anilino5((3((4bromo35dimethylpyrazol1yl)methyl)4methoxyphenyl)methylidene)13thiazol4one
(5Z)5(3((4bromo35dimethyl1Hpyrazol1yl)methyl)4methoxybenzylidene)2(phenylamino)13thiazol4(5H)one
CC1=C(C(=NN1CC2=C(C=CC(=C2)C=C3C(=O)N=C(S3)NC4=CC=CC=C4)OC)C)Br
COc1ccc(cc1Cn1nc(c(c1C)Br)C)C=C1SC(=NC1=O)Nc1ccccc1
InChI=1SC23H21BrN4O2Sc11421(24)15(2)28(2714)13171116(91019(17)303)122022(29)2623(3120)25187546818h412H13H213H3(H252629)b2012
MFCD11853967
ZINC000032561930
ZINC32561930
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