Vitas-M small molecule compound
2-(3-chloro-4-methylphenyl)-5-phenylhexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Catalog ID
STK257701
SMILES O=C1N(c2ccc(c(c2)Cl)C)C(=O)C2C1C1CC2CC1c1ccccc1
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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 C22H20ClNO2 MW 365.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClNO2/c1-12-7-8-15(11-18(12)23)24-21(25)19-14-9-16(13-5-3-2-4-6-13)17(10-14)20(19)22(24)26/h2-8,11,14,16-17,19-20H,9-10H2,1H3InChIKey
BTYRELSNOQTVBI-UHFFFAOYSA-NSynonyms
2(3CHLORO4METHYLPHENYL)5PHENYLHEXAHYDRO1H47METHANOISOINDOLE13(2H)DIONE
CC1=C(C=C(C=C1)N2C(=O)C3C4CC(C3C2=O)C(C4)C5=CC=CC=C5)Cl
InChI=1SC22H20ClNO2c1127815(1118(12)23)2421(25)1914916(135324613)17(1014)20(19)22(24)26h28111416171920H910H21H3
MFCD03900810
ZINC000102550226
ZINC000239025568
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