3-[(4-bromanyl-3-methyl-phenyl)amino]-2-(4-methylpyridin-2-yl)-3H-isoindol-1-one

Systemtic Name: 3-[(4-bromanyl-3-methyl-phenyl)amino]-2-(4-methylpyridin-2-yl)-3H-isoindol-1-one Openeye Name: 3-(4-bromo-3-methyl-anilino)-2-(4-methyl-2-pyridyl)isoindolin-1-one CAS Name: 3-(4-bromo-3-methylanilino)-2-(4-methyl-2-pyridinyl)-3H-isoindol-1-one IUPAC Name: 3-(4-bromo-3-methylanilino)-2-(4-methylpyridin-2-yl)-3H-isoindol-1-one Traditional Name: 3-(4-bromo-3-methyl-anilino)-2-(4-methyl-2-pyridyl)isoindolin-1-one Formula: C21H18BrN3O MolecularWeight: 408.29112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)N2C(C3=CC=CC=C3C2=O)NC4=CC(=C(C=C4)Br)C

Isomeric SMILES

CC1=CC(=NC=C1)N2C(C3=CC=CC=C3C2=O)NC4=CC(=C(C=C4)Br)C

InChI

InChI=1S/C21H18BrN3O/c1-13-9-10-23-19(11-13)25-20(16-5-3-4-6-17(16)21(25)26)24-15-7-8-18(22)14(2)12-15/h3-12,20,24H,1-2H3