Vitas-M small molecule compound
2-[4-chloro-3-(trifluoromethyl)phenyl]-3a,4,7,7a-tetrahydro-1H-spiro[2-aza-4,7-methanoisoindole-8,1'-cyclopropane]-1,3(2H)-dione
Catalog ID
STK280876
SMILES O=C1N(c2ccc(c(c2)C(F)(F)F)Cl)C(=O)C2C1C1C=CC2C21CC2
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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 C18H13ClF3NO2 MW 367.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13ClF3NO2/c19-12-4-1-8(7-11(12)18(20,21)22)23-15(24)13-9-2-3-10(14(13)16(23)25)17(9)5-6-17/h1-4,7,9-10,13-14H,5-6H2InChIKey
YKNXPBGMSRCWMF-UHFFFAOYSA-NSynonyms
2(4chloro3(trifluoromethyl)phenyl)3a477atetrahydro1Hspiro(2aza47methanoisoindole81cyclopropane)13(2H)dione
C1CC12C3C=CC2C4C3C(=O)N(C4=O)C5=CC(=C(C=C5)Cl)C(F)(F)F
InChI=1SC18H13ClF3NO2c1912418(711(12)18(2021)22)2315(24)1392310(14(13)16(23)25)17(9)5617h1479101314H56H2
MFCD01067485
ZINC000239433762
ZINC000239433764
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