Vitas-M small molecule compound

cyclopropyl{5-[(2-methoxybenzyl)amino]-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl}methanone

Catalog ID
STK227725
SMILES COc1ccccc1CNc1nc(nn1C(=O)C1CC1)c1cccnc1

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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 C19H19N5O2 MW 349.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N5O2/c1-26-16-7-3-2-5-14(16)12-21-19-22-17(15-6-4-10-20-11-15)23-24(19)18(25)13-8-9-13/h2-7,10-11,13H,8-9,12H2,1H3,(H,21,22,23)
InChIKey
BQAJNBSVEJPZMY-UHFFFAOYSA-N
Synonyms

COC1=CC=CC=C1CNC2=NC(=NN2C(=O)C3CC3)C4=CN=CC=C4
CYCLOPROPYL(5((2METHOXYBENZYL)AMINO)3(PYRIDIN3YL)1H124TRIAZOL1YL)METHANONE
CYCLOPROPYL(5((2METHOXYPHENYL)METHYLAMINO)3PYRIDIN3YL124TRIAZOL1YL)METHANONE
InChI=1SC19H19N5O2c12616732514(16)1221192217(156410201115)2324(19)18(25)138913h27101113H8912H21H3(H212223)
MFCD07792150
ZINC000004732601
ZINC04732601
ZINC4732601

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Available files

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