Vitas-M small molecule compound

N-(4-bromo-3-methylphenyl)-5-(4-chlorophenyl)-1H-pyrazole-3-carboxamide

Catalog ID
STL026735
SMILES Clc1ccc(cc1)c1[nH]nc(c1)C(=O)Nc1ccc(c(c1)C)Br

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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 C17H13BrClN3O MW 390.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13BrClN3O/c1-10-8-13(6-7-14(10)18)20-17(23)16-9-15(21-22-16)11-2-4-12(19)5-3-11/h2-9H,1H3,(H,20,23)(H,21,22)
InChIKey
XHDADHIJFAOAFA-UHFFFAOYSA-N
Synonyms

CC1=C(C=CC(=C1)NC(=O)C2=CC(=NN2)C3=CC=C(C=C3)Cl)Br
Clc1ccc(cc1)c1(nH)nc(c1)C(=O)Nc1ccc(c(c1)C)Br
InChI=1SC17H13BrClN3Oc110813(6714(10)18)2017(23)16915(212216)112412(19)5311h29H1H3(H2023)(H2122)
MFCD18187434
N(4bromo3methylphenyl)3(4chlorophenyl)1Hpyrazole5carboxamide
N(4bromo3methylphenyl)5(4chlorophenyl)1Hpyrazole3carboxamide
ZINC000057412143
ZINC57412143

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.