3-[[3-(aminomethyl)cyclohexyl]methyl]-2-(4-phenylphenyl)quinazolin-4-one

Systemtic Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-2-(4-phenylphenyl)quinazolin-4-one Openeye Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-2-(4-phenylphenyl)quinazolin-4-one CAS Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-2-(4-phenylphenyl)-4-quinazolinone IUPAC Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-2-(4-phenylphenyl)quinazolin-4-one Traditional Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-2-(4-phenylphenyl)quinazolin-4-one Formula: C28H29N3O MolecularWeight: 423.54936

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(C1)CN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)C5=CC=CC=C5)CN

Isomeric SMILES

C1CC(CC(C1)CN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)C5=CC=CC=C5)CN

InChI

InChI=1S/C28H29N3O/c29-18-20-7-6-8-21(17-20)19-31-27(30-26-12-5-4-11-25(26)28(31)32)24-15-13-23(14-16-24)22-9-2-1-3-10-22/h1-5,9-16,20-21H,6-8,17-19,29H2