Vitas-M small molecule compound

1-{3,5-bis[(2-methoxybenzyl)amino]-1H-1,2,4-triazol-1-yl}-2-phenoxypropan-1-one

Catalog ID
STK187579
SMILES COc1ccccc1CNc1nc(nn1C(=O)C(Oc1ccccc1)C)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 C27H29N5O4 MW 487.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O4/c1-19(36-22-13-5-4-6-14-22)25(33)32-27(29-18-21-12-8-10-16-24(21)35-3)30-26(31-32)28-17-20-11-7-9-15-23(20)34-2/h4-16,19H,17-18H2,1-3H3,(H2,28,29,30,31)
InChIKey
DYKNLOXIWYNYNX-UHFFFAOYSA-N
Synonyms

1(35BIS((2METHOXYBENZYL)AMINO)1H124TRIAZOL1YL)2PHENOXYPROPAN1ONE
1(35bis((2methoxyphenyl)methylamino)124triazol1yl)2phenoxypropan1one
CC(C(=O)N1C(=NC(=N1)NCC2=CC=CC=C2OC)NCC3=CC=CC=C3OC)OC4=CC=CC=C4
InChI=1SC27H29N5O4c119(3622135461422)25(33)3227(291821128101624(21)353)3026(3132)28172011791523(20)342h41619H1718H213H3(H228293031)
MFCD06664558
ZINC000009907510
ZINC000009907511

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Available files

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