Vitas-M small molecule compound
5-[4-(3-methoxyphenyl)piperazin-1-yl]-2-(4-methylphenyl)-2H-1,2,3-triazole-4-carbonitrile
Catalog ID
STL437223
SMILES COc1cccc(c1)N1CCN(CC1)c1nn(nc1C#N)c1ccc(cc1)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 C21H22N6O MW 374.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N6O/c1-16-6-8-17(9-7-16)27-23-20(15-22)21(24-27)26-12-10-25(11-13-26)18-4-3-5-19(14-18)28-2/h3-9,14H,10-13H2,1-2H3InChIKey
OJZFBWCAPXQRII-UHFFFAOYSA-NSynonyms
5(4(3methoxyphenyl)piperazin1yl)2(4methylphenyl)2H123triazole4carbonitrile
5(4(3methoxyphenyl)piperazin1yl)2(4methylphenyl)triazole4carbonitrile
CC1=CC=C(C=C1)N2N=C(C(=N2)N3CCN(CC3)C4=CC(=CC=C4)OC)C#N
InChI=1SC21H22N6Oc1166817(9716)272320(1522)21(2427)26121025(111326)1843519(1418)282h3914H1013H212H3
MFCD08273085
ZINC000008694299
ZINC8694299
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