Vitas-M small molecule compound

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

Catalog ID
STK151361
SMILES CCOc1cc(ccc1OCC)C(=O)Nn1cnnc1

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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 C13H16N4O3 MW 276.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N4O3/c1-3-19-11-6-5-10(7-12(11)20-4-2)13(18)16-17-8-14-15-9-17/h5-9H,3-4H2,1-2H3,(H,16,18)
InChIKey
CSCMOAKLYHAPKK-UHFFFAOYSA-N
Synonyms

(34DIETHOXYPHENYL)N(124TRIAZOL4YL)CARBOXAMIDE
34DIETHOXYN(124)TRIAZOL4YLBENZAMIDE
34DIETHOXYN(124TRIAZOL4YL)BENZAMIDE
34DIETHOXYN(4H124TRIAZOL4YL)BENZAMIDE
CCOC1=C(C=C(C=C1)C(=O)NN2C=NN=C2)OCC
InChI=1SC13H16N4O3c1319116510(712(11)2042)13(18)161781415917h59H34H212H3(H1618)
MFCD01195948
ZINC000004476271
ZINC04476271
ZINC4476271

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Available files

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