3-[[3-(aminomethyl)phenyl]methyl]-2-(4-tert-butylphenyl)-6-methoxy-quinazolin-4-one

Systemtic Name: 3-[[3-(aminomethyl)phenyl]methyl]-2-(4-tert-butylphenyl)-6-methoxy-quinazolin-4-one Openeye Name: 3-[[3-(aminomethyl)phenyl]methyl]-2-(4-tert-butylphenyl)-6-methoxy-quinazolin-4-one CAS Name: 3-[[3-(aminomethyl)phenyl]methyl]-2-(4-tert-butylphenyl)-6-methoxy-4-quinazolinone IUPAC Name: 3-[[3-(aminomethyl)phenyl]methyl]-2-(4-tert-butylphenyl)-6-methoxyquinazolin-4-one Traditional Name: 3-[3-(aminomethyl)benzyl]-2-(4-tert-butylphenyl)-6-methoxy-quinazolin-4-one Formula: C27H29N3O2 MolecularWeight: 427.53806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)OC)C(=O)N2CC4=CC(=CC=C4)CN

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)OC)C(=O)N2CC4=CC(=CC=C4)CN

InChI

InChI=1S/C27H29N3O2/c1-27(2,3)21-10-8-20(9-11-21)25-29-24-13-12-22(32-4)15-23(24)26(31)30(25)17-19-7-5-6-18(14-19)16-28/h5-15H,16-17,28H2,1-4H3