Vitas-M small molecule compound
4-({3-[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-6-oxo-5,6-dihydropyridazin-1(4H)-yl}acetyl)-1-(2-phenylethyl)piperazine-2,6-dione
Catalog ID
STL185343
SMILES O=C1CCC(=NN1CC(=O)N1CC(=O)N(C(=O)C1)CCc1ccccc1)c1onc(n1)c1ccc2c(c1)OCO2
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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 C27H24N6O7 MW 544.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24N6O7/c34-22-9-7-19(27-28-26(30-40-27)18-6-8-20-21(12-18)39-16-38-20)29-33(22)15-23(35)31-13-24(36)32(25(37)14-31)11-10-17-4-2-1-3-5-17/h1-6,8,12H,7,9-11,13-16H2InChIKey
JFZKYJHXIAULCD-UHFFFAOYSA-NSynonyms
4((3(3(13benzodioxol5yl)124oxadiazol5yl)6oxo56dihydropyridazin1(4H)yl)acetyl)1(2phenylethyl)piperazine26dione
4(2(3(3(13benzodioxol5yl)124oxadiazol5yl)6oxo45dihydropyridazin1yl)acetyl)1(2phenylethyl)piperazine26dione
C1CC(=O)N(N=C1C2=NC(=NO2)C3=CC4=C(C=C3)OCO4)CC(=O)N5CC(=O)N(C(=O)C5)CCC6=CC=CC=C6
InChI=1SC27H24N6O7c34229719(272826(304027)18682021(1218)39163820)2933(22)1523(35)311324(36)32(25(37)1431)1110174213517h16812H79111316H2
MFCD22387474
ZINC000101356525
ZINC101356525
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