4-(4-bromophenyl)-1-methyl-5-[6-[methyl(prop-2-enyl)amino]hexoxy]quinazolin-2-one

Systemtic Name: 4-(4-bromophenyl)-1-methyl-5-[6-[methyl(prop-2-enyl)amino]hexoxy]quinazolin-2-one Openeye Name: 5-[6-[allyl(methyl)amino]hexoxy]-4-(4-bromophenyl)-1-methyl-quinazolin-2-one CAS Name: 4-(4-bromophenyl)-1-methyl-5-[6-[methyl(prop-2-enyl)amino]hexoxy]-2-quinazolinone IUPAC Name: 4-(4-bromophenyl)-1-methyl-5-[6-[methyl(prop-2-enyl)amino]hexoxy]quinazolin-2-one Traditional Name: 5-[6-[allyl(methyl)amino]hexoxy]-4-(4-bromophenyl)-1-methyl-quinazolin-2-one Formula: C25H30BrN3O2 MolecularWeight: 484.4286

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=CC=C2)OCCCCCCN(C)CC=C)C(=NC1=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CN1C2=C(C(=CC=C2)OCCCCCCN(C)CC=C)C(=NC1=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C25H30BrN3O2/c1-4-16-28(2)17-7-5-6-8-18-31-22-11-9-10-21-23(22)24(27-25(30)29(21)3)19-12-14-20(26)15-13-19/h4,9-15H,1,5-8,16-18H2,2-3H3