Vitas-M small molecule compound
1-[3,5-bis(benzylamino)-1H-1,2,4-triazol-1-yl]-2-(2,4-dichlorophenoxy)ethanone
Catalog ID
STK187571
SMILES Clc1ccc(c(c1)Cl)OCC(=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 C24H21Cl2N5O2 MW 482.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21Cl2N5O2/c25-19-11-12-21(20(26)13-19)33-16-22(32)31-24(28-15-18-9-5-2-6-10-18)29-23(30-31)27-14-17-7-3-1-4-8-17/h1-13H,14-16H2,(H2,27,28,29,30)InChIKey
PHOIWJYKXSDXQZ-UHFFFAOYSA-NSynonyms
1(35bis(benzylamino)124triazol1yl)2(24dichlorophenoxy)ethanone
1(35BIS(BENZYLAMINO)1H124TRIAZOL1YL)2(24DICHLOROPHENOXY)ETHANONE
C1=CC=C(C=C1)CNC2=NN(C(=N2)NCC3=CC=CC=C3)C(=O)COC4=C(C=C(C=C4)Cl)Cl
InChI=1SC24H21Cl2N5O2c2519111221(20(26)1319)331622(32)3124(28151895261018)2923(3031)2714177314817h113H1416H2(H227282930)
MFCD06664550
ZINC000009907504
ZINC09907504
ZINC9907504
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