3-(4-bromanyl-2-methyl-phenyl)-6-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-methyl-quinazolin-4-one

Systemtic Name: 3-(4-bromanyl-2-methyl-phenyl)-6-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-methyl-quinazolin-4-one Openeye Name: 3-(4-bromo-2-methyl-phenyl)-6-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-methyl-quinazolin-4-one CAS Name: 3-(4-bromo-2-methylphenyl)-6-[4-(3,3-diphenylpropyl)-1-piperazinyl]-2-methyl-4-quinazolinone IUPAC Name: 3-(4-bromo-2-methylphenyl)-6-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-methylquinazolin-4-one Traditional Name: 3-(4-bromo-2-methyl-phenyl)-6-[4-(3,3-diphenylpropyl)piperazino]-2-methyl-quinazolin-4-one Formula: C35H35BrN4O MolecularWeight: 607.5826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)N2C(=NC3=C(C2=O)C=C(C=C3)N4CCN(CC4)CCC(C5=CC=CC=C5)C6=CC=CC=C6)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)N2C(=NC3=C(C2=O)C=C(C=C3)N4CCN(CC4)CCC(C5=CC=CC=C5)C6=CC=CC=C6)C

InChI

InChI=1S/C35H35BrN4O/c1-25-23-29(36)13-16-34(25)40-26(2)37-33-15-14-30(24-32(33)35(40)41)39-21-19-38(20-22-39)18-17-31(27-9-5-3-6-10-27)28-11-7-4-8-12-28/h3-16,23-24,31H,17-22H2,1-2H3