Vitas-M small molecule compound

N-(4-chlorobenzyl)-2H-3,4'-bi-1,2,4-triazole-5-carboxamide

Catalog ID
STK688410
SMILES Clc1ccc(cc1)CNC(=O)c1n[nH]c(n1)n1cnnc1

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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 C12H10ClN7O MW 303.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H10ClN7O/c13-9-3-1-8(2-4-9)5-14-11(21)10-17-12(19-18-10)20-6-15-16-7-20/h1-4,6-7H,5H2,(H,14,21)(H,17,18,19)
InChIKey
PXOPCLRGGCEUBE-UHFFFAOYSA-N
Synonyms

C1=CC(=CC=C1CNC(=O)C2=NC(=NN2)N3C=NN=C3)Cl
Clc1ccc(cc1)CNC(=O)c1n(nH)c(n1)n1cnnc1
InChI=1SC12H10ClN7Oc139318(249)51411(21)101712(191810)2061516720h1467H5H2(H1421)(H171819)
MFCD07657540
N((4CHLOROPHENYL)METHYL)3(124TRIAZOL4YL)1H124TRIAZOLE5CARBOXAMIDE
N(4chlorobenzyl)2H34bi124triazole5carboxamide
ZINC000004772714
ZINC4772714

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Available files

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