Vitas-M small molecule compound
1-(5-{2-[(2,4-dichlorobenzyl)oxy]phenyl}-4-[4-(dimethylamino)phenyl]-1-phenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl)ethanone
Catalog ID
STK510729
SMILES Clc1ccc(c(c1)Cl)COc1ccccc1C1N(N=C(N1c1ccc(cc1)N(C)C)C(=O)C)c1ccccc1
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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 C31H28Cl2N4O2 MW 559.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28Cl2N4O2/c1-21(38)30-34-37(26-9-5-4-6-10-26)31(36(30)25-17-15-24(16-18-25)35(2)3)27-11-7-8-12-29(27)39-20-22-13-14-23(32)19-28(22)33/h4-19,31H,20H2,1-3H3InChIKey
PCAAPDILQYFKER-UHFFFAOYSA-NSynonyms
1(3(2((24dichlorophenyl)methoxy)phenyl)4(4(dimethylamino)phenyl)2phenyl3H124triazol5yl)ethanone
1(3(2((24DICHLOROPHENYL)METHOXY)PHENYL)4(4DIMETHYLAMINOPHENYL)2PHENYL3H124TRIAZOL5YL)ETHANONE
1(5(2((24dichlorobenzyl)oxy)phenyl)4(4(dimethylamino)phenyl)1phenyl45dihydro1H124triazol3yl)ethanone
CC(=O)C1=NN(C(N1C2=CC=C(C=C2)N(C)C)C3=CC=CC=C3OCC4=C(C=C(C=C4)Cl)Cl)C5=CC=CC=C5
InChI=1SC31H28Cl2N4O2c121(38)303437(2695461026)31(36(30)25171524(161825)35(2)3)2711781229(27)392022131423(32)1928(22)33h41931H20H213H3
MFCD02623378
ZINC000002137999
ZINC000002138002
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