Vitas-M small molecule compound
2-(3-fluorobenzyl)-5-[(phenylamino)methyl]-1,2-dihydro-3H-1,2,4-triazol-3-one
Catalog ID
STK695556
SMILES Fc1cccc(c1)Cn1[nH]c(nc1=O)CNc1ccccc1
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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 C16H15FN4O MW 298.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15FN4O/c17-13-6-4-5-12(9-13)11-21-16(22)19-15(20-21)10-18-14-7-2-1-3-8-14/h1-9,18H,10-11H2,(H,19,20,22)InChIKey
XMQMKJGCNSATTQ-UHFFFAOYSA-NSynonyms
1192657-04-71192657047
2(3fluorobenzyl)5((phenylamino)methyl)12dihydro3H124triazol3one
2(3fluorobenzyl)5((phenylamino)methyl)1H124triazol3(2H)one
5(anilinomethyl)2((3fluorophenyl)methyl)1H124triazol3one
C1=CC=C(C=C1)NCC2=NC(=O)N(N2)CC3=CC(=CC=C3)F
Fc1cccc(c1)Cn1(nH)c(nc1=O)CNc1ccccc1
InChI=1SC16H15FN4Oc171364512(913)112116(22)1915(2021)1018147213814h1918H1011H2(H192022)
MFCD16625418
ZINC000036559148
ZINC36559148
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