2-(4-tert-butylphenyl)-7-(pyridin-4-ylamino)-3H-isoindol-1-one

Systemtic Name: 2-(4-tert-butylphenyl)-7-(pyridin-4-ylamino)-3H-isoindol-1-one Openeye Name: 2-(4-tert-butylphenyl)-7-(4-pyridylamino)isoindolin-1-one CAS Name: 2-(4-tert-butylphenyl)-7-(pyridin-4-ylamino)-3H-isoindol-1-one IUPAC Name: 2-(4-tert-butylphenyl)-7-(pyridin-4-ylamino)-3H-isoindol-1-one Traditional Name: 2-(4-tert-butylphenyl)-7-(4-pyridylamino)isoindolin-1-one Formula: C23H23N3O MolecularWeight: 357.44822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N2CC3=C(C2=O)C(=CC=C3)NC4=CC=NC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N2CC3=C(C2=O)C(=CC=C3)NC4=CC=NC=C4

InChI

InChI=1S/C23H23N3O/c1-23(2,3)17-7-9-19(10-8-17)26-15-16-5-4-6-20(21(16)22(26)27)25-18-11-13-24-14-12-18/h4-14H,15H2,1-3H3,(H,24,25)