Vitas-M small molecule compound
2-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
Catalog ID
STK326800
SMILES O=C1C2C3C=CC(C2C(=O)N1c1c(C)n(n(c1=O)c1ccccc1)C)C1C3C1
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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 C22H21N3O3 MW 375.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O3/c1-11-19(22(28)25(23(11)2)12-6-4-3-5-7-12)24-20(26)17-13-8-9-14(16-10-15(13)16)18(17)21(24)27/h3-9,13-18H,10H2,1-2H3InChIKey
QKMUGOSVGDEHFO-UHFFFAOYSA-NSynonyms
(3AR4S4AR5AS6R6AS)2(15DIMETHYL3OXO2PHENYL23DIHYDRO1HPYRAZOL4YL)HEXAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOLE13(2H3AH)DIONE
2(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)44a55a66ahexahydro46ethenocyclopropa(f)isoindole13(2H3aH)dione
2(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)hexahydro46ethenocyclopropa(f)isoindole13(2H3aH)dione
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N3C(=O)C4C5C=CC(C4C3=O)C6C5C6
InChI=1SC22H21N3O3c11119(22(28)25(23(11)2)126435712)2420(26)17138914(161015(13)16)18(17)21(24)27h391318H10H212H3
MFCD02189111
ZINC000195281711
ZINC000245238484
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