3-(3-azanylpropyl)-2-[4-(2,4-dimethoxyphenyl)phenyl]quinazolin-4-one

Systemtic Name: 3-(3-azanylpropyl)-2-[4-(2,4-dimethoxyphenyl)phenyl]quinazolin-4-one Openeye Name: 3-(3-aminopropyl)-2-[4-(2,4-dimethoxyphenyl)phenyl]quinazolin-4-one CAS Name: 3-(3-aminopropyl)-2-[4-(2,4-dimethoxyphenyl)phenyl]-4-quinazolinone IUPAC Name: 3-(3-aminopropyl)-2-[4-(2,4-dimethoxyphenyl)phenyl]quinazolin-4-one Traditional Name: 3-(3-aminopropyl)-2-[4-(2,4-dimethoxyphenyl)phenyl]quinazolin-4-one Formula: C25H25N3O3 MolecularWeight: 415.4843

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=CC=C(C=C2)C3=NC4=CC=CC=C4C(=O)N3CCCN)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2=CC=C(C=C2)C3=NC4=CC=CC=C4C(=O)N3CCCN)OC

InChI

InChI=1S/C25H25N3O3/c1-30-19-12-13-20(23(16-19)31-2)17-8-10-18(11-9-17)24-27-22-7-4-3-6-21(22)25(29)28(24)15-5-14-26/h3-4,6-13,16H,5,14-15,26H2,1-2H3