Vitas-M small molecule compound
2-(3,5-dimethylbenzyl)-3-methyl-4-oxo-4-(phenylamino)butanoic acid
Catalog ID
STL442341
SMILES O=C(C(C(C(=O)O)Cc1cc(C)cc(c1)C)C)Nc1ccccc1
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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 C20H23NO3 MW 325.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23NO3/c1-13-9-14(2)11-16(10-13)12-18(20(23)24)15(3)19(22)21-17-7-5-4-6-8-17/h4-11,15,18H,12H2,1-3H3,(H,21,22)(H,23,24)InChIKey
ANBMXTJXOBLPPU-UHFFFAOYSA-NSynonyms
2(35dimethylbenzyl)3methyl4oxo4(phenylamino)butanoicacid
4anilino2((35dimethylphenyl)methyl)3methyl4oxobutanoicacid
CC1=CC(=CC(=C1)CC(C(C)C(=O)NC2=CC=CC=C2)C(=O)O)C
InChI=1SC20H23NO3c113914(2)1116(1013)1218(20(23)24)15(3)19(22)21177546817h4111518H12H213H3(H2122)(H2324)
MFCD19442621
ZINC000071405947
ZINC000071405950
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