Vitas-M small molecule compound
{5-[(3,4-dimethylphenyl)amino]-1H-1,2,3-triazol-4-yl}[4-(furan-2-ylcarbonyl)piperazin-1-yl]methanone
Catalog ID
STL098913
SMILES O=C(c1nn[nH]c1Nc1ccc(c(c1)C)C)N1CCN(CC1)C(=O)c1ccco1
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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 C20H22N6O3 MW 394.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N6O3/c1-13-5-6-15(12-14(13)2)21-18-17(22-24-23-18)20(28)26-9-7-25(8-10-26)19(27)16-4-3-11-29-16/h3-6,11-12H,7-10H2,1-2H3,(H2,21,22,23,24)InChIKey
MFUBXKFCJUCFEC-UHFFFAOYSA-NSynonyms
(4(5(34dimethylanilino)2Htriazole4carbonyl)piperazin1yl)(furan2yl)methanone
(5((34dimethylphenyl)amino)1H123triazol4yl)(4(furan2ylcarbonyl)piperazin1yl)methanone
CC1=C(C=C(C=C1)NC2=NNN=C2C(=O)N3CCN(CC3)C(=O)C4=CC=CO4)C
InChI=1SC20H22N6O3c1135615(1214(13)2)211817(22242318)20(28)269725(81026)19(27)1643112916h361112H710H212H3(H221222324)
MFCD18790156
O=C(c1nn(nH)c1Nc1ccc(c(c1)C)C)N1CCN(CC1)C(=O)c1ccco1
ZINC000067284591
ZINC67284591
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