Vitas-M small molecule compound

N-[1-(4-fluorobenzyl)-1H-1,2,4-triazol-3-yl]-3-methyl-4-nitrobenzamide

Catalog ID
STK463643
SMILES Fc1ccc(cc1)Cn1cnc(n1)NC(=O)c1ccc(c(c1)C)[N+](=O)[O-]

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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 C17H14FN5O3 MW 355.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14FN5O3/c1-11-8-13(4-7-15(11)23(25)26)16(24)20-17-19-10-22(21-17)9-12-2-5-14(18)6-3-12/h2-8,10H,9H2,1H3,(H,20,21,24)
InChIKey
DSMXLKUNUJBTMG-UHFFFAOYSA-N
Synonyms

CC1=C(C=CC(=C1)C(=O)NC2=NN(C=N2)CC3=CC=C(C=C3)F)(N+)(=O)(O)
Fc1ccc(cc1)Cn1cnc(n1)NC(=O)c1ccc(c(c1)C)(N+)(=O)(O)
InChI=1SC17H14FN5O3c111813(4715(11)23(25)26)16(24)2017191022(2117)9122514(18)6312h2810H9H21H3(H202124)
MFCD06004247
N(1((4FLUOROPHENYL)METHYL)(124TRIAZOL3YL))(3METHYL4NITROPHENYL)CARBOXAMIDE
N(1((4FLUOROPHENYL)METHYL)124TRIAZOL3YL)3METHYL4NITROBENZAMIDE
N(1(4fluorobenzyl)1H124triazol3yl)3methyl4nitrobenzamide
ZINC000001053743
ZINC01053743
ZINC1053743

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Available files

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