Vitas-M small molecule compound

N,N'-bis(3-bromobenzyl)-1H-1,2,4-triazole-3,5-diamine

Catalog ID
STK169891
SMILES Brc1cccc(c1)CNc1[nH]nc(n1)NCc1cccc(c1)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 C16H15Br2N5 MW 437.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15Br2N5/c17-13-5-1-3-11(7-13)9-19-15-21-16(23-22-15)20-10-12-4-2-6-14(18)8-12/h1-8H,9-10H2,(H3,19,20,21,22,23)
InChIKey
QRINLTNILPBFES-UHFFFAOYSA-N
Synonyms

3N5Nbis((3bromophenyl)methyl)1H124triazole35diamine
Brc1cccc(c1)CNc1(nH)nc(n1)NCc1cccc(c1)Br
C1=CC(=CC(=C1)Br)CNC2=NC(=NN2)NCC3=CC(=CC=C3)Br
InChI=1SC16H15Br2N5c171351311(713)919152116(232215)20101242614(18)812h18H910H2(H31920212223)
MFCD06663411
NNBIS(3BROMOBENZYL)1H124TRIAZOLE35DIAMINE
ZINC000009847123
ZINC09847123
ZINC9847123

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Available files

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