Vitas-M small molecule compound
4-[(2,6-dimethylphenyl)amino]-4-oxo-2-{[4-(pyridin-2-yl)piperazin-1-yl]methyl}butanoic acid
Catalog ID
STL159395
SMILES O=C(Nc1c(C)cccc1C)CC(C(=O)O)CN1CCN(CC1)c1ccccn1
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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 C22H28N4O3 MW 396.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N4O3/c1-16-6-5-7-17(2)21(16)24-20(27)14-18(22(28)29)15-25-10-12-26(13-11-25)19-8-3-4-9-23-19/h3-9,18H,10-15H2,1-2H3,(H,24,27)(H,28,29)InChIKey
RVJDLPAKDXKTAA-UHFFFAOYSA-NSynonyms
1282112-00-81282112008
4((26dimethylphenyl)amino)4oxo2((4(pyridin2yl)piperazin1yl)methyl)butanoicacid
4(26dimethylanilino)4oxo2((4pyridin2ylpiperazin1yl)methyl)butanoicacid
CC1=C(C(=CC=C1)C)NC(=O)CC(CN2CCN(CC2)C3=CC=CC=N3)C(=O)O
InChI=1SC22H28N4O3c11665717(2)21(16)2420(27)1418(22(28)29)1525101226(131125)1983492319h3918H1015H212H3(H2427)(H2829)
MFCD18800306
ZINC000061722098
ZINC000061722099
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