Vitas-M small molecule compound
1-[5-{2-[(4-chlorobenzyl)oxy]phenyl}-4-(4-chlorophenyl)-1-phenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethanone
Catalog ID
STK760731
SMILES Clc1ccc(cc1)COc1ccccc1C1N(N=C(N1c1ccc(cc1)Cl)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 C29H23Cl2N3O2 MW 516.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23Cl2N3O2/c1-20(35)28-32-34(25-7-3-2-4-8-25)29(33(28)24-17-15-23(31)16-18-24)26-9-5-6-10-27(26)36-19-21-11-13-22(30)14-12-21/h2-18,29H,19H2,1H3InChIKey
IXHKUFIQWWVQOV-UHFFFAOYSA-NSynonyms
1(4(4CHLOROPHENYL)3(2((4CHLOROPHENYL)METHOXY)PHENYL)2PHENYL3H124TRIAZOL5YL)ETHANONE
1(5(2((4chlorobenzyl)oxy)phenyl)4(4chlorophenyl)1phenyl45dihydro1H124triazol3yl)ethanone
CC(=O)C1=NN(C(N1C2=CC=C(C=C2)Cl)C3=CC=CC=C3OCC4=CC=C(C=C4)Cl)C5=CC=CC=C5
InChI=1SC29H23Cl2N3O2c120(35)283234(257324825)29(33(28)24171523(31)161824)269561027(26)361921111322(30)141221h21829H19H21H3
MFCD01819523
ZINC000002185815
ZINC000002185816
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