Vitas-M small molecule compound

{3,5-bis[(4-methylbenzyl)amino]-1H-1,2,4-triazol-1-yl}(3-methoxyphenyl)methanone

Catalog ID
STK187622
SMILES COc1cccc(c1)C(=O)n1nc(nc1NCc1ccc(cc1)C)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 C26H27N5O2 MW 441.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5O2/c1-18-7-11-20(12-8-18)16-27-25-29-26(28-17-21-13-9-19(2)10-14-21)31(30-25)24(32)22-5-4-6-23(15-22)33-3/h4-15H,16-17H2,1-3H3,(H2,27,28,29,30)
InChIKey
CCZMQYBXYZGLLQ-UHFFFAOYSA-N
Synonyms

(35BIS((4METHYLBENZYL)AMINO)1H124TRIAZOL1YL)(3METHOXYPHENYL)METHANONE
(35bis((4methylphenyl)methylamino)124triazol1yl)(3methoxyphenyl)methanone
CC1=CC=C(C=C1)CNC2=NN(C(=N2)NCC3=CC=C(C=C3)C)C(=O)C4=CC(=CC=C4)OC
InChI=1SC26H27N5O2c11871120(12818)1627252926(28172113919(2)101421)31(3025)24(32)2254623(1522)333h415H1617H213H3(H227282930)
MFCD06664596
ZINC000009907547
ZINC09907547
ZINC9907547

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Available files

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