Vitas-M small molecule compound
1-{1-(4-chlorophenyl)-5-{2-[(2,4-dichlorobenzyl)oxy]phenyl}-4-[4-(diethylamino)phenyl]-4,5-dihydro-1H-1,2,4-triazol-3-yl}ethanone
Catalog ID
STK510730
SMILES CCN(c1ccc(cc1)N1C(=NN(C1c1ccccc1OCc1ccc(cc1Cl)Cl)c1ccc(cc1)Cl)C(=O)C)CC
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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 C33H31Cl3N4O2 MW 621.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H31Cl3N4O2/c1-4-38(5-2)26-16-18-27(19-17-26)39-32(22(3)41)37-40(28-14-12-24(34)13-15-28)33(39)29-8-6-7-9-31(29)42-21-23-10-11-25(35)20-30(23)36/h6-20,33H,4-5,21H2,1-3H3InChIKey
AWFKWGILTBACIP-UHFFFAOYSA-NSynonyms
1(1(4chlorophenyl)5(2((24dichlorobenzyl)oxy)phenyl)4(4(diethylamino)phenyl)45dihydro1H124triazol3yl)ethanone
1(2(4CHLOROPHENYL)3(2((24DICHLOROPHENYL)METHOXY)PHENYL)4(4(DIETHYLAMINO)PHENYL)3H124TRIAZOL5YL)ETHANONE
CCN(CC)C1=CC=C(C=C1)N2C(N(N=C2C(=O)C)C3=CC=C(C=C3)Cl)C4=CC=CC=C4OCC5=C(C=C(C=C5)Cl)Cl
InChI=1SC33H31Cl3N4O2c1438(52)26161827(191726)3932(22(3)41)3740(28141224(34)131528)33(39)29867931(29)422123101125(35)2030(23)36h62033H4521H213H3
MFCD02182321
ZINC000008442956
ZINC000008442958
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