Vitas-M small molecule compound

diethyl (2Z)-2-{amino[(phenylcarbonyl)amino]methylidene}-3-oxopentanedioate

Catalog ID
STK262161
SMILES CCOC(=O)/C(=C(\NC(=O)c1ccccc1)/N)/C(=O)CC(=O)OCC

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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 C17H20N2O6 MW 348.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N2O6/c1-3-24-13(21)10-12(20)14(17(23)25-4-2)15(18)19-16(22)11-8-6-5-7-9-11/h5-9H,3-4,10,18H2,1-2H3,(H,19,22)/b15-14-
InChIKey
WLWRMRUKHALXSX-PFONDFGASA-N
Synonyms

CCOC(=O)C(=C(NC(=O)c1ccccc1)N)C(=O)CC(=O)OCC
CCOC(=O)CC(=O)C(=C(N)NC(=O)C1=CC=CC=C1)C(=O)OCC
diethyl(2Z)2(amino((phenylcarbonyl)amino)methylidene)3oxopentanedioate
diethyl(2Z)2(amino(benzamido)methylidene)3oxopentanedioate
DIETHYL2(AMINO(PHENYLCARBONYLAMINO)METHYLENE)3OXOPENTANE15DIOATE
InChI=1SC17H20N2O6c132413(21)1012(20)14(17(23)2542)15(18)1916(22)118657911h59H341018H212H3(H1922)b1514
MFCD08545695
ZINC000100430753
ZINC100430753

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Available files

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