Vitas-M small molecule compound
1-{3,5-bis[(2-methoxybenzyl)amino]-1H-1,2,4-triazol-1-yl}-2-phenylethanone
Catalog ID
STK169758
SMILES COc1ccccc1CNc1nn(c(n1)NCc1ccccc1OC)C(=O)Cc1ccccc1
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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 C26H27N5O3 MW 457.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5O3/c1-33-22-14-8-6-12-20(22)17-27-25-29-26(28-18-21-13-7-9-15-23(21)34-2)31(30-25)24(32)16-19-10-4-3-5-11-19/h3-15H,16-18H2,1-2H3,(H2,27,28,29,30)InChIKey
LROAKBPBXNKFDV-UHFFFAOYSA-NSynonyms
1(35BIS((2METHOXYBENZYL)AMINO)1H124TRIAZOL1YL)2PHENYLETHANONE
1(35BIS((2METHOXYPHENYL)METHYLAMINO)124TRIAZOL1YL)2PHENYLETHANONE
COC1=CC=CC=C1CNC2=NN(C(=N2)NCC3=CC=CC=C3OC)C(=O)CC4=CC=CC=C4
InChI=1SC26H27N5O3c1332214861220(22)1727252926(28182113791523(21)342)31(3025)24(32)1619104351119h315H1618H212H3(H227282930)
MFCD06629374
ZINC000001068113
ZINC01068113
ZINC1068113
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