Vitas-M small molecule compound

5-{[(4-methoxyphenyl)amino]methyl}-2-propyl-1,2-dihydro-3H-1,2,4-triazol-3-one

Catalog ID
STK940066
SMILES CCCn1[nH]c(nc1=O)CNc1ccc(cc1)OC

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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 C13H18N4O2 MW 262.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H18N4O2/c1-3-8-17-13(18)15-12(16-17)9-14-10-4-6-11(19-2)7-5-10/h4-7,14H,3,8-9H2,1-2H3,(H,15,16,18)
InChIKey
BWWUWDZNCPOWDA-UHFFFAOYSA-N
Synonyms
1219587-16-2
1219587162
5(((4methoxyphenyl)amino)methyl)2propyl12dihydro3H124triazol3one
5(((4methoxyphenyl)amino)methyl)2propyl1H124triazol3(2H)one
5((4methoxyanilino)methyl)2propyl1H124triazol3one
CCCn1(nH)c(nc1=O)CNc1ccc(cc1)OC
CCCN1C(=O)N=C(N1)CNC2=CC=C(C=C2)OC
InChI=1SC13H18N4O2c1381713(18)1512(1617)914104611(192)7510h4714H389H212H3(H151618)
MFCD16624705
ZINC000040268613
ZINC40268613

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Available files

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