Vitas-M small molecule compound
1-{3,5-bis[(2-chlorobenzyl)amino]-1H-1,2,4-triazol-1-yl}-2-phenoxypropan-1-one
Catalog ID
STK187613
SMILES CC(C(=O)n1nc(nc1NCc1ccccc1Cl)NCc1ccccc1Cl)Oc1ccccc1
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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 C25H23Cl2N5O2 MW 496.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23Cl2N5O2/c1-17(34-20-11-3-2-4-12-20)23(33)32-25(29-16-19-10-6-8-14-22(19)27)30-24(31-32)28-15-18-9-5-7-13-21(18)26/h2-14,17H,15-16H2,1H3,(H2,28,29,30,31)InChIKey
BQIXRUXCGQMRNC-UHFFFAOYSA-NSynonyms
1(35BIS((2CHLOROBENZYL)AMINO)1H124TRIAZOL1YL)2PHENOXYPROPAN1ONE
1(35bis((2chlorophenyl)methylamino)124triazol1yl)2phenoxypropan1one
CC(C(=O)N1C(=NC(=N1)NCC2=CC=CC=C2Cl)NCC3=CC=CC=C3Cl)OC4=CC=CC=C4
InChI=1SC25H23Cl2N5O2c117(3420113241220)23(33)3225(29161910681422(19)27)3024(3132)2815189571321(18)26h21417H1516H21H3(H228293031)
MFCD06664587
ZINC000009907538
ZINC000009907539
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