Vitas-M small molecule compound
1-{3,5-bis[(2-methoxybenzyl)amino]-1H-1,2,4-triazol-1-yl}-3-phenylpropan-1-one
Catalog ID
STK178865
SMILES COc1ccccc1CNc1nc(nn1C(=O)CCc1ccccc1)NCc1ccccc1OC
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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 C27H29N5O3 MW 471.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O3/c1-34-23-14-8-6-12-21(23)18-28-26-30-27(29-19-22-13-7-9-15-24(22)35-2)32(31-26)25(33)17-16-20-10-4-3-5-11-20/h3-15H,16-19H2,1-2H3,(H2,28,29,30,31)InChIKey
VCCWEZRKYZWUHC-UHFFFAOYSA-NSynonyms
1(35BIS((2METHOXYBENZYL)AMINO)1H124TRIAZOL1YL)3PHENYLPROPAN1ONE
1(35bis((2methoxyphenyl)methylamino)124triazol1yl)3phenylpropan1one
COC1=CC=CC=C1CNC2=NN(C(=N2)NCC3=CC=CC=C3OC)C(=O)CCC4=CC=CC=C4
InChI=1SC27H29N5O3c1342314861221(23)1828263027(29192213791524(22)352)32(3126)25(33)171620104351120h315H1619H212H3(H228293031)
MFCD06663938
ZINC000009948501
ZINC09948501
ZINC9948501
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