Vitas-M small molecule compound

4-bromo-N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide

Catalog ID
STK304051
SMILES O=C(c1n(C)nc(c1Br)C(F)(F)F)Nc1sc2c(c1C(=O)N)CCCC2

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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 C15H14BrF3N4O2S MW 451.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14BrF3N4O2S/c1-23-10(9(16)11(22-23)15(17,18)19)13(25)21-14-8(12(20)24)6-4-2-3-5-7(6)26-14/h2-5H2,1H3,(H2,20,24)(H,21,25)
InChIKey
REANLNLVBIOGCT-UHFFFAOYSA-N
Synonyms
1005636-36-1
1005636361
4bromoN(3carbamoyl4567tetrahydro1benzothiophen2yl)1methyl3(trifluoromethyl)1Hpyrazole5carboxamide
4bromoN(3carbamoyl4567tetrahydro1benzothiophen2yl)2methyl5(trifluoromethyl)pyrazole3carboxamide
CN1C(=C(C(=N1)C(F)(F)F)Br)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)N
InChI=1SC15H14BrF3N4O2Sc12310(9(16)11(2223)15(1718)19)13(25)21148(12(20)24)642357(6)2614h25H21H3(H22024)(H2125)
MFCD04044097
ZINC000002779236
ZINC02779236
ZINC2779236

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Available files

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