Vitas-M small molecule compound
(2E)-4-[(2,4-di-tert-butyl-6-methylphenyl)amino]-4-oxobut-2-enoic acid
Catalog ID
STL019545
SMILES OC(=O)/C=C/C(=O)Nc1c(C)cc(cc1C(C)(C)C)C(C)(C)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 C19H27NO3 MW 317.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H27NO3/c1-12-10-13(18(2,3)4)11-14(19(5,6)7)17(12)20-15(21)8-9-16(22)23/h8-11H,1-7H3,(H,20,21)(H,22,23)/b9-8+InChIKey
ATAPINMWSGGUOX-CMDGGOBGSA-NSynonyms
(2E)3(N(24BIS(TERTBUTYL)6METHYLPHENYL)CARBAMOYL)PROP2ENOICACID
(2E)4((24ditertbutyl6methylphenyl)amino)4oxobut2enoicacid
(E)4(24DITERTBUTYL6METHYLANILINO)4OXOBUT2ENOICACID
CC1=C(C(=CC(=C1)C(C)(C)C)C(C)(C)C)NC(=O)C=CC(=O)O
InChI=1SC19H27NO3c1121013(18(23)4)1114(19(56)7)17(12)2015(21)8916(22)23h811H17H3(H2021)(H2223)b98+
MFCD00590675
OC(=O)C=CC(=O)Nc1c(C)cc(cc1C(C)(C)C)C(C)(C)C
ZINC000000139586
ZINC139586
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