Vitas-M small molecule compound
(2E)-1-(5-bromothiophen-2-yl)-3-(1,5-dimethyl-1H-pyrazol-4-yl)prop-2-en-1-one
Catalog ID
STL403429
SMILES Brc1ccc(s1)C(=O)/C=C/c1cnn(c1C)C
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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 C12H11BrN2OS MW 311.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11BrN2OS/c1-8-9(7-14-15(8)2)3-4-10(16)11-5-6-12(13)17-11/h3-7H,1-2H3/b4-3+InChIKey
KVUZWXAXPLRFPO-ONEGZZNKSA-NSynonyms
1005616-54-5(2E)1(5bromothiophen2yl)3(15dimethyl1Hpyrazol4yl)prop2en1one
(E)1(5BROMOTHIOPHEN2YL)3(15DIMETHYLPYRAZOL4YL)PROP2EN1ONE
1005616545
Brc1ccc(s1)C(=O)C=Cc1cnn(c1C)C
CC1=C(C=NN1C)C=CC(=O)C2=CC=C(S2)Br
InChI=1SC12H11BrN2OSc189(71415(8)2)3410(16)115612(13)1711h37H12H3b43+
MFCD04048775
ZINC000006527489
ZINC06527489
ZINC6527489
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