Vitas-M small molecule compound

3-{[(3-chlorophenyl)amino]methyl}-1-(3-phenylpropyl)-1H-1,2,4-triazol-5-ol

Catalog ID
STL155877
SMILES Clc1cccc(c1)NCc1nc(n(n1)CCCc1ccccc1)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 C18H19ClN4O MW 342.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19ClN4O/c19-15-9-4-10-16(12-15)20-13-17-21-18(24)23(22-17)11-5-8-14-6-2-1-3-7-14/h1-4,6-7,9-10,12,20H,5,8,11,13H2,(H,21,22,24)
InChIKey
RWWFCASPLGOPGK-UHFFFAOYSA-N
Synonyms
1310939-98-0
1310939980
3(((3chlorophenyl)amino)methyl)1(3phenylpropyl)1H124triazol5ol
5((3chloroanilino)methyl)2(3phenylpropyl)1H124triazol3one
C1=CC=C(C=C1)CCCN2C(=O)N=C(N2)CNC3=CC(=CC=C3)Cl
InChI=1SC18H19ClN4Oc1915941016(1215)2013172118(24)23(2217)1158146213714h14679101220H581113H2(H212224)
MFCD20757472
ZINC000071282529
ZINC71282529

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Available files

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