Vitas-M small molecule compound
2-{[(4E)-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-ylideneamino]oxy}-1-(3,4-dihydroisoquinolin-2(1H)-yl)ethanone
Catalog ID
STK687466
SMILES O=C(N1CCc2c(C1)cccc2)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 C17H18N4O3 MW 326.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N4O3/c22-16(21-9-8-12-4-1-2-5-13(12)10-21)11-23-18-14-6-3-7-15-17(14)20-24-19-15/h1-2,4-5H,3,6-11H2/b18-14+InChIKey
BJJIWZBOMIEEMJ-NBVRZTHBSA-NSynonyms
2(((4E)67dihydro213benzoxadiazol4(5H)ylideneamino)oxy)1(34dihydroisoquinolin2(1H)yl)ethanone
2((E)67dihydro5H213benzoxadiazol4ylideneamino)oxy1(34dihydro1Hisoquinolin2yl)ethanone
213BENZOXADIAZOL4(5H)ONE67DIHYDROO(2(34DIHYDRO2(1H)ISOQUINOLINYL)2OXOETHYL)OXIME
C1CC2=NON=C2C(=NOCC(=O)N3CCC4=CC=CC=C4C3)C1
InChI=1SC17H18N4O3c2216(219812412513(12)1021)112318146371517(14)20241915h1245H3611H2b1814+
MFCD06618952
O=C(N1CCc2c(C1)cccc2)CON=C1CCCc2c1non2
ZINC000004753317
ZINC38321605
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