Vitas-M small molecule compound

1-[5-{2-[(2,6-dichlorobenzyl)oxy]phenyl}-4-(3,4-dichlorophenyl)-1-phenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethanone

Catalog ID
STK760730
SMILES CC(=O)C1=NN(C(N1c1ccc(c(c1)Cl)Cl)c1ccccc1OCc1c(Cl)cccc1Cl)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 C29H21Cl4N3O2 MW 585.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H21Cl4N3O2/c1-18(37)28-34-36(19-8-3-2-4-9-19)29(35(28)20-14-15-25(32)26(33)16-20)21-10-5-6-13-27(21)38-17-22-23(30)11-7-12-24(22)31/h2-16,29H,17H2,1H3
InChIKey
WXNZUNKSFPDIGZ-UHFFFAOYSA-N
Synonyms

1((5R)5(2((26DICHLOROBENZYL)OXY)PHENYL)4(34DICHLOROPHENYL)1PHENYL45DIHYDRO1H124TRIAZOL3YL)ETHANONE
1((5S)5(2((26DICHLOROBENZYL)OXY)PHENYL)4(34DICHLOROPHENYL)1PHENYL45DIHYDRO1H124TRIAZOL3YL)ETHANONE
1(4(34DICHLOROPHENYL)3(2((26DICHLOROPHENYL)METHOXY)PHENYL)2PHENYL3H124TRIAZOL5YL)ETHANONE
1(5(2((26dichlorobenzyl)oxy)phenyl)4(34dichlorophenyl)1phenyl45dihydro1H124triazol3yl)ethanone
CC(=O)C1=NN(C(N1C2=CC(=C(C=C2)Cl)Cl)C3=CC=CC=C3OCC4=C(C=CC=C4Cl)Cl)C5=CC=CC=C5
InChI=1SC29H21Cl4N3O2c118(37)283436(198324919)29(35(28)20141525(32)26(33)1620)2110561327(21)38172223(30)1171224(22)31h21629H17H21H3
MFCD01819522
ZINC000002185813
ZINC000002185814

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Available files

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