Vitas-M small molecule compound
1-[4-cyclohexyl-5-(1H-indol-3-yl)-1-(4-methoxyphenyl)-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethanone
Catalog ID
STL360294
SMILES COc1ccc(cc1)N1N=C(N(C1c1c[nH]c2c1cccc2)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 C25H28N4O2 MW 416.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N4O2/c1-17(30)24-27-29(19-12-14-20(31-2)15-13-19)25(28(24)18-8-4-3-5-9-18)22-16-26-23-11-7-6-10-21(22)23/h6-7,10-16,18,25-26H,3-5,8-9H2,1-2H3InChIKey
NKRNTJWYFUWBJU-UHFFFAOYSA-NSynonyms
1(4CYCLOHEXYL3(1HINDOL3YL)2(4METHOXYPHENYL)3H124TRIAZOL5YL)ETHANONE
1(4cyclohexyl5(1Hindol3yl)1(4methoxyphenyl)45dihydro1H124triazol3yl)ethanone
CC(=O)C1=NN(C(N1C2CCCCC2)C3=CNC4=CC=CC=C43)C5=CC=C(C=C5)OC
COc1ccc(cc1)N1N=C(N(C1c1c(nH)c2c1cccc2)C1CCCCC1)C(=O)C
InChI=1SC25H28N4O2c117(30)242729(19121420(312)151319)25(28(24)188435918)2216262311761021(22)23h671016182526H3589H212H3
MFCD02237420
ZINC000002295714
ZINC000002295715
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