Vitas-M small molecule compound

4-butoxy-N-(4H-1,2,4-triazol-3-yl)benzamide

Catalog ID
STK225785
SMILES CCCCOc1ccc(cc1)C(=O)Nc1[nH]cnn1

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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 C13H16N4O2 MW 260.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N4O2/c1-2-3-8-19-11-6-4-10(5-7-11)12(18)16-13-14-9-15-17-13/h4-7,9H,2-3,8H2,1H3,(H2,14,15,16,17,18)
InChIKey
LVOSGPQWQVEIRV-UHFFFAOYSA-N
Synonyms
879079-57-9
4BUTOXYN(1H124TRIAZOL5YL)BENZAMIDE
4butoxyN(4H124triazol3yl)benzamide
879079579
CCCCOC1=CC=C(C=C1)C(=O)NC2=NC=NN2
CCCCOc1ccc(cc1)C(=O)Nc1(nH)cnn1
InChI=1SC13H16N4O2c123819116410(5711)12(18)1613149151713h479H238H21H3(H21415161718)
MFCD07038096
ZINC000004834290
ZINC4834290

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Available files

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