Vitas-M small molecule compound
1-[5-{4-[(4-chlorobenzyl)oxy]-3-methoxyphenyl}-1-(4-chlorophenyl)-4-(4-methoxyphenyl)-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethanone
Catalog ID
STK510711
SMILES COc1ccc(cc1)N1C(=NN(C1c1ccc(c(c1)OC)OCc1ccc(cc1)Cl)c1ccc(cc1)Cl)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 C31H27Cl2N3O4 MW 576.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27Cl2N3O4/c1-20(37)30-34-36(26-11-9-24(33)10-12-26)31(35(30)25-13-15-27(38-2)16-14-25)22-6-17-28(29(18-22)39-3)40-19-21-4-7-23(32)8-5-21/h4-18,31H,19H2,1-3H3InChIKey
VDQZVFJIPKZOBC-UHFFFAOYSA-NSynonyms
1(2(4CHLOROPHENYL)3(4((4CHLOROPHENYL)METHOXY)3METHOXYPHENYL)4(4METHOXYPHENYL)3H124TRIAZOL5YL)ETHANONE
1(5(4((4chlorobenzyl)oxy)3methoxyphenyl)1(4chlorophenyl)4(4methoxyphenyl)45dihydro1H124triazol3yl)ethanone
CC(=O)C1=NN(C(N1C2=CC=C(C=C2)OC)C3=CC(=C(C=C3)OCC4=CC=C(C=C4)Cl)OC)C5=CC=C(C=C5)Cl
InChI=1SC31H27Cl2N3O4c120(37)303436(2611924(33)101226)31(35(30)25131527(382)161425)2261728(29(1822)393)4019214723(32)8521h41831H19H213H3
MFCD01820618
ZINC000002185811
ZINC000002185812
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