Vitas-M small molecule compound
1-[5-{2-[(4-chlorobenzyl)oxy]phenyl}-4-(4-methoxyphenyl)-1-phenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethanone
Catalog ID
STL439742
SMILES COc1ccc(cc1)N1C(=NN(C1c1ccccc1OCc1ccc(cc1)Cl)c1ccccc1)C(=O)C
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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 C30H26ClN3O3 MW 512.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26ClN3O3/c1-21(35)29-32-34(25-8-4-3-5-9-25)30(33(29)24-16-18-26(36-2)19-17-24)27-10-6-7-11-28(27)37-20-22-12-14-23(31)15-13-22/h3-19,30H,20H2,1-2H3InChIKey
RFSQMLLHDDTOKZ-UHFFFAOYSA-NSynonyms
1(3(2((4CHLOROPHENYL)METHOXY)PHENYL)4(4METHOXYPHENYL)2PHENYL3H124TRIAZOL5YL)ETHANONE
1(5(2((4chlorobenzyl)oxy)phenyl)4(4methoxyphenyl)1phenyl45dihydro1H124triazol3yl)ethanone
1(5(2(4CHLOROBENZYLOXY)PHENYL)4(4METHOXYPHENYL)1PHENYL45DIHYDRO1H124TRIAZOL3YL)ETHANONE
CC(=O)C1=NN(C(N1C2=CC=C(C=C2)OC)C3=CC=CC=C3OCC4=CC=C(C=C4)Cl)C5=CC=CC=C5
InChI=1SC30H26ClN3O3c121(35)293234(258435925)30(33(29)24161826(362)191724)2710671128(27)372022121423(31)151322h31930H20H212H3
MFCD06242711
ZINC000003766966
ZINC000003766967
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