Vitas-M small molecule compound
[3,5-bis(benzylamino)-1H-1,2,4-triazol-1-yl](2-methoxyphenyl)methanone
Catalog ID
STK187560
SMILES COc1ccccc1C(=O)n1nc(nc1NCc1ccccc1)NCc1ccccc1
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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 C24H23N5O2 MW 413.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N5O2/c1-31-21-15-9-8-14-20(21)22(30)29-24(26-17-19-12-6-3-7-13-19)27-23(28-29)25-16-18-10-4-2-5-11-18/h2-15H,16-17H2,1H3,(H2,25,26,27,28)InChIKey
CEBKSJMBCGDZLK-UHFFFAOYSA-NSynonyms
(35BIS(BENZYLAMINO)124TRIAZOL1YL)(2METHOXYPHENYL)METHANONE
(35BIS(BENZYLAMINO)1H124TRIAZOL1YL)(2METHOXYPHENYL)METHANONE
COC1=CC=CC=C1C(=O)N2C(=NC(=N2)NCC3=CC=CC=C3)NCC4=CC=CC=C4
InChI=1SC24H23N5O2c1312115981420(21)22(30)2924(261719126371319)2723(2829)251618104251118h215H1617H21H3(H225262728)
MFCD06628842
ZINC000004723804
ZINC04723804
ZINC4723804
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