Vitas-M small molecule compound
methyl 4-[({[(4E)-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-ylideneamino]oxy}acetyl)amino]benzoate
Catalog ID
STK681977
SMILES COC(=O)c1ccc(cc1)NC(=O)CO/N=C/1\CCCc2c1non2
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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 C16H16N4O5 MW 344.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O5/c1-23-16(22)10-5-7-11(8-6-10)17-14(21)9-24-18-12-3-2-4-13-15(12)20-25-19-13/h5-8H,2-4,9H2,1H3,(H,17,21)/b18-12+InChIKey
NBGSLIXLPDACLM-LDADJPATSA-NSynonyms
BENZOICACID4(2(67DIHYDRO5HBENZO(125)OXADIAZOL4YLIDENEAMINOOXY)ACETYLAMINO)METHYLESTER
COC(=O)C1=CC=C(C=C1)NC(=O)CON=C2CCCC3=NON=C32
COC(=O)c1ccc(cc1)NC(=O)CON=C1CCCc2c1non2
InChI=1SC16H16N4O5c12316(22)105711(8610)1714(21)92418123241315(12)20251913h58H249H21H3(H1721)b1812+
methyl4(((((4E)67dihydro213benzoxadiazol4(5H)ylideneamino)oxy)acetyl)amino)benzoate
METHYL4((2((E)67DIHYDRO5H213BENZOXADIAZOL4YLIDENEAMINO)OXYACETYL)AMINO)BENZOATE
MFCD03820830
ZINC000000108795
ZINC108798
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