Vitas-M small molecule compound
4-(quinoxalin-2-yl)phenyl (1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)acetate
Catalog ID
STL172686
SMILES O=C(CN1C(=O)C2C(C1=O)C1C=CC2C2C1C2)Oc1ccc(cc1)c1cnc2c(n1)cccc2
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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 C27H21N3O4 MW 451.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21N3O4/c31-23(13-30-26(32)24-16-9-10-17(19-11-18(16)19)25(24)27(30)33)34-15-7-5-14(6-8-15)22-12-28-20-3-1-2-4-21(20)29-22/h1-10,12,16-19,24-25H,11,13H2InChIKey
ZSUCWJHXLSEOGC-UHFFFAOYSA-NSynonyms
488832-06-04(quinoxalin2yl)phenyl(13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)acetate
488832060
C1C2C1C3C=CC2C4C3C(=O)N(C4=O)CC(=O)OC5=CC=C(C=C5)C6=NC7=CC=CC=C7N=C6
InChI=1SC27H21N3O4c3123(133026(32)241691017(191118(16)19)25(24)27(30)33)34157514(6815)22122820312421(20)2922h1101216192425H1113H2
MFCD02376125
ZINC000245241264
ZINC000245241267
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