Vitas-M small molecule compound
1-{3,5-bis[(4-methylbenzyl)amino]-1H-1,2,4-triazol-1-yl}-3-phenylpropan-1-one
Catalog ID
STK169899
SMILES Cc1ccc(cc1)CNc1nc(n(n1)C(=O)CCc1ccccc1)NCc1ccc(cc1)C
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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 C27H29N5O MW 439.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O/c1-20-8-12-23(13-9-20)18-28-26-30-27(29-19-24-14-10-21(2)11-15-24)32(31-26)25(33)17-16-22-6-4-3-5-7-22/h3-15H,16-19H2,1-2H3,(H2,28,29,30,31)InChIKey
ULFBMIOHLYZLJC-UHFFFAOYSA-NSynonyms
1(35BIS((4METHYLBENZYL)AMINO)1H124TRIAZOL1YL)3PHENYLPROPAN1ONE
1(35bis((4methylphenyl)methylamino)124triazol1yl)3phenylpropan1one
CC1=CC=C(C=C1)CNC2=NN(C(=N2)NCC3=CC=C(C=C3)C)C(=O)CCC4=CC=CC=C4
InChI=1SC27H29N5Oc12081223(13920)1828263027(291924141021(2)111524)32(3126)25(33)1716226435722h315H1619H212H3(H228293031)
MFCD06663417
ZINC000009847127
ZINC09847127
ZINC9847127
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