Vitas-M small molecule compound

4-bromo-N,N-di(butan-2-yl)-1-methyl-1H-pyrazole-3-carboxamide

Catalog ID
STL401010
SMILES CCC(N(C(=O)c1nn(cc1Br)C)C(CC)C)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 C13H22BrN3O MW 316.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H22BrN3O/c1-6-9(3)17(10(4)7-2)13(18)12-11(14)8-16(5)15-12/h8-10H,6-7H2,1-5H3
InChIKey
XOYCPYJCULUQDJ-UHFFFAOYSA-N
Synonyms
1005635-90-4
1005635904
4bromoNNdi(butan2yl)1methyl1Hpyrazole3carboxamide
4bromoNNdi(butan2yl)1methylpyrazole3carboxamide
CCC(C)N(C(C)CC)C(=O)C1=NN(C=C1Br)C
InChI=1SC13H22BrN3Oc169(3)17(10(4)72)13(18)1211(14)816(5)1512h810H67H215H3
MFCD04056035
ZINC000002779183
ZINC000017053658

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Available files

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