N-(2,5-dimethylphenyl)carbonyl-2,5-dimethyl-N-(3-pyridin-2-ylisoquinolin-1-yl)benzamide

Systemtic Name: N-(2,5-dimethylphenyl)carbonyl-2,5-dimethyl-N-(3-pyridin-2-ylisoquinolin-1-yl)benzamide Openeye Name: N-(2,5-dimethylbenzoyl)-2,5-dimethyl-N-[3-(2-pyridyl)-1-isoquinolyl]benzamide CAS Name: N-[(2,5-dimethylphenyl)-oxomethyl]-2,5-dimethyl-N-[3-(2-pyridinyl)-1-isoquinolinyl]benzamide IUPAC Name: N-(2,5-dimethylbenzoyl)-2,5-dimethyl-N-(3-pyridin-2-ylisoquinolin-1-yl)benzamide Traditional Name: N-(2,5-dimethylbenzoyl)-2,5-dimethyl-N-[3-(2-pyridyl)-1-isoquinolyl]benzamide Formula: C32H27N3O2 MolecularWeight: 485.57568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)N(C2=NC(=CC3=CC=CC=C32)C4=CC=CC=N4)C(=O)C5=C(C=CC(=C5)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)N(C2=NC(=CC3=CC=CC=C32)C4=CC=CC=N4)C(=O)C5=C(C=CC(=C5)C)C

InChI

InChI=1S/C32H27N3O2/c1-20-12-14-22(3)26(17-20)31(36)35(32(37)27-18-21(2)13-15-23(27)4)30-25-10-6-5-9-24(25)19-29(34-30)28-11-7-8-16-33-28/h5-19H,1-4H3