Vitas-M small molecule compound

tert-butyl (2E)-2-{4-[(2-methoxy-5-methylphenyl)amino]-4-oxobutan-2-ylidene}hydrazinecarboxylate

Catalog ID
STK076461
SMILES COc1ccc(cc1NC(=O)C/C(=N/NC(=O)OC(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 C17H25N3O4 MW 335.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H25N3O4/c1-11-7-8-14(23-6)13(9-11)18-15(21)10-12(2)19-20-16(22)24-17(3,4)5/h7-9H,10H2,1-6H3,(H,18,21)(H,20,22)/b19-12+
InChIKey
RPVFUSOKSGNOIS-XDHOZWIPSA-N
Synonyms

CC1=CC(=C(C=C1)OC)NC(=O)CC(=NNC(=O)OC(C)(C)C)C
COc1ccc(cc1NC(=O)CC(=NNC(=O)OC(C)(C)C)C)C
InChI=1SC17H25N3O4c1117814(236)13(911)1815(21)1012(2)192016(22)2417(34)5h79H10H216H3(H1821)(H2022)b1912+
MFCD01428451
STK076461
TERTBUTYL(2E)2(4((2METHOXY5METHYLPHENYL)AMINO)4OXOBUTAN2YLIDENE)HYDRAZINECARBOXYLATE
tertbutylN((E)(4(2methoxy5methylanilino)4oxobutan2ylidene)amino)carbamate
ZINC000004600477
ZINC101477179

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.