N-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)quinazolin-4-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)quinazolin-4-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)quinazolin-4-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)-4-quinazolinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)quinazolin-4-amine Traditional Name: [2-(4-bromophenyl)quinazolin-4-yl]-piperonyl-amine Formula: C22H16BrN3O2 MolecularWeight: 434.28534

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=NC(=NC4=CC=CC=C43)C5=CC=C(C=C5)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=NC(=NC4=CC=CC=C43)C5=CC=C(C=C5)Br

InChI

InChI=1S/C22H16BrN3O2/c23-16-8-6-15(7-9-16)21-25-18-4-2-1-3-17(18)22(26-21)24-12-14-5-10-19-20(11-14)28-13-27-19/h1-11H,12-13H2,(H,24,25,26)