2-[[(4-bromophenyl)methyl-butyl-amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[(4-bromophenyl)methyl-butyl-amino]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[(4-bromophenyl)methyl-butyl-amino]methyl]-1H-quinazolin-4-one CAS Name: 2-[[(4-bromophenyl)methyl-butylamino]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[(4-bromophenyl)methyl-butylamino]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[(4-bromobenzyl)-butyl-amino]methyl]-1H-quinazolin-4-one Formula: C20H22BrN3O MolecularWeight: 400.31218

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=C(C=C1)Br)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCCCN(CC1=CC=C(C=C1)Br)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C20H22BrN3O/c1-2-3-12-24(13-15-8-10-16(21)11-9-15)14-19-22-18-7-5-4-6-17(18)20(25)23-19/h4-11H,2-3,12-14H2,1H3,(H,22,23,25)