Vitas-M small molecule compound
(2E)-4-{2-[(4-tert-butylphenyl)carbonyl]hydrazinyl}-2-methyl-4-oxobut-2-enoic acid
Catalog ID
STK428604
SMILES O=C(c1ccc(cc1)C(C)(C)C)NNC(=O)/C=C(/C(=O)O)\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 C16H20N2O4 MW 304.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N2O4/c1-10(15(21)22)9-13(19)17-18-14(20)11-5-7-12(8-6-11)16(2,3)4/h5-9H,1-4H3,(H,17,19)(H,18,20)(H,21,22)/b10-9+InChIKey
WGYKUOFXIYQDGC-MDZDMXLPSA-NSynonyms
(2E)3(N((4(TERTBUTYL)PHENYL)CARBONYLAMINO)CARBAMOYL)2METHYLPROP2ENOICACID
(2E)4(2((4tertbutylphenyl)carbonyl)hydrazinyl)2methyl4oxobut2enoicacid
(E)4(2(4TERTBUTYLBENZOYL)HYDRAZINYL)2METHYL4OXOBUT2ENOICACID
CC(=CC(=O)NNC(=O)C1=CC=C(C=C1)C(C)(C)C)C(=O)O
InChI=1SC16H20N2O4c110(15(21)22)913(19)171814(20)115712(8611)16(23)4h59H14H3(H1719)(H1820)(H2122)b109+
MFCD03465238
O=C(c1ccc(cc1)C(C)(C)C)NNC(=O)C=C(C(=O)O)C
ZINC000005827744
ZINC5827744
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