Vitas-M small molecule compound

(2E)-4-{[4-(tert-butylcarbamoyl)phenyl]amino}-4-oxobut-2-enoic acid

Catalog ID
STL068035
SMILES O=C(Nc1ccc(cc1)C(=O)NC(C)(C)C)/C=C/C(=O)O

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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 C15H18N2O4 MW 290.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18N2O4/c1-15(2,3)17-14(21)10-4-6-11(7-5-10)16-12(18)8-9-13(19)20/h4-9H,1-3H3,(H,16,18)(H,17,21)(H,19,20)/b9-8+
InChIKey
MTSHPRGXXATLPV-CMDGGOBGSA-N
Synonyms
940453-79-2
(2E)3((4(TERTBUTYLCARBAMOYL)PHENYL)CARBAMOYL)PROP2ENOICACID
(2E)3(N(4(N(TERTBUTYL)CARBAMOYL)PHENYL)CARBAMOYL)PROP2ENOICACID
(2E)4((4(tertbutylcarbamoyl)phenyl)amino)4oxobut2enoicacid
(E)4(4((TERTBUTYLAMINO)CARBONYL)ANILINO)4OXO2BUTENOICACID
(E)4(4(tertbutylcarbamoyl)anilino)4oxobut2enoicacid
4((4((TERTBUTYLAMINO)CARBONYL)PHENYL)AMINO)4OXO2BUTENOICACID
940453792
CC(C)(C)NC(=O)C1=CC=C(C=C1)NC(=O)C=CC(=O)O
InChI=1SC15H18N2O4c115(23)1714(21)104611(7510)1612(18)8913(19)20h49H13H3(H1618)(H1721)(H1920)b98+
MFCD09439777
O=C(Nc1ccc(cc1)C(=O)NC(C)(C)C)C=CC(=O)O
ZINC000012138865
ZINC12138865

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Available files

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