Vitas-M small molecule compound

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

Catalog ID
STK222341
SMILES Cc1ccc(cc1)CNc1nc(nn1C(=O)c1ccc(cc1)F)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 C22H18FN5O MW 387.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18FN5O/c1-15-4-6-16(7-5-15)13-25-22-26-20(18-3-2-12-24-14-18)27-28(22)21(29)17-8-10-19(23)11-9-17/h2-12,14H,13H2,1H3,(H,25,26,27)
InChIKey
FOQQCNMUVKNCRG-UHFFFAOYSA-N
Synonyms

(4FLUOROPHENYL)(5((4METHYLBENZYL)AMINO)3(PYRIDIN3YL)1H124TRIAZOL1YL)METHANONE
(4FLUOROPHENYL)(5((4METHYLPHENYL)METHYLAMINO)3PYRIDIN3YL124TRIAZOL1YL)METHANONE
CC1=CC=C(C=C1)CNC2=NC(=NN2C(=O)C3=CC=C(C=C3)F)C4=CN=CC=C4
InChI=1SC22H18FN5Oc1154616(7515)1325222620(183212241418)2728(22)21(29)1781019(23)11917h21214H13H21H3(H252627)
MFCD08671709
ZINC000004816451
ZINC04816451
ZINC4816451

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Available files

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