Vitas-M small molecule compound
2-(4-methoxyphenyl)-5-[4-(3-methoxyphenyl)piperazin-1-yl]-2H-1,2,3-triazole-4-carbonitrile
Catalog ID
STL437215
SMILES COc1ccc(cc1)n1nc(c(n1)N1CCN(CC1)c1cccc(c1)OC)C#N
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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 C21H22N6O2 MW 390.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N6O2/c1-28-18-8-6-16(7-9-18)27-23-20(15-22)21(24-27)26-12-10-25(11-13-26)17-4-3-5-19(14-17)29-2/h3-9,14H,10-13H2,1-2H3InChIKey
XPOUOKPAILNIDN-UHFFFAOYSA-NSynonyms
2(4methoxyphenyl)5(4(3methoxyphenyl)piperazin1yl)2H123triazole4carbonitrile
2(4methoxyphenyl)5(4(3methoxyphenyl)piperazin1yl)triazole4carbonitrile
COC1=CC=C(C=C1)N2N=C(C(=N2)N3CCN(CC3)C4=CC(=CC=C4)OC)C#N
InChI=1SC21H22N6O2c128188616(7918)272320(1522)21(2427)26121025(111326)1743519(1417)292h3914H1013H212H3
MFCD08273079
ZINC000008694295
ZINC8694295
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