2-[[4-[2-(4-bromanylphenoxy)propanoyl]piperazin-1-yl]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[4-[2-(4-bromanylphenoxy)propanoyl]piperazin-1-yl]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[4-[2-(4-bromophenoxy)propanoyl]piperazin-1-yl]methyl]-1H-quinazolin-4-one CAS Name: 2-[[4-[2-(4-bromophenoxy)-1-oxopropyl]-1-piperazinyl]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[4-[2-(4-bromophenoxy)propanoyl]piperazin-1-yl]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[4-[2-(4-bromophenoxy)propanoyl]piperazino]methyl]-1H-quinazolin-4-one Formula: C22H23BrN4O3 MolecularWeight: 471.34702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)CC2=NC(=O)C3=CC=CC=C3N2)OC4=CC=C(C=C4)Br

Isomeric SMILES

CC(C(=O)N1CCN(CC1)CC2=NC(=O)C3=CC=CC=C3N2)OC4=CC=C(C=C4)Br

InChI

InChI=1S/C22H23BrN4O3/c1-15(30-17-8-6-16(23)7-9-17)22(29)27-12-10-26(11-13-27)14-20-24-19-5-3-2-4-18(19)21(28)25-20/h2-9,15H,10-14H2,1H3,(H,24,25,28)