N-[4-bromanyl-2-(phenylcarbonyl)phenyl]-1-(6-methyl-4-phenyl-quinazolin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-[4-bromanyl-2-(phenylcarbonyl)phenyl]-1-(6-methyl-4-phenyl-quinazolin-2-yl)piperidine-4-carboxamide Openeye Name: N-(2-benzoyl-4-bromo-phenyl)-1-(6-methyl-4-phenyl-quinazolin-2-yl)piperidine-4-carboxamide CAS Name: N-(2-benzoyl-4-bromophenyl)-1-(6-methyl-4-phenyl-2-quinazolinyl)-4-piperidinecarboxamide IUPAC Name: N-(2-benzoyl-4-bromophenyl)-1-(6-methyl-4-phenylquinazolin-2-yl)piperidine-4-carboxamide Traditional Name: N-(2-benzoyl-4-bromo-phenyl)-1-(6-methyl-4-phenyl-quinazolin-2-yl)isonipecotamide Formula: C34H29BrN4O2 MolecularWeight: 605.52366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N=C2C3=CC=CC=C3)N4CCC(CC4)C(=O)NC5=C(C=C(C=C5)Br)C(=O)C6=CC=CC=C6

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N=C2C3=CC=CC=C3)N4CCC(CC4)C(=O)NC5=C(C=C(C=C5)Br)C(=O)C6=CC=CC=C6

InChI

InChI=1S/C34H29BrN4O2/c1-22-12-14-29-27(20-22)31(23-8-4-2-5-9-23)38-34(37-29)39-18-16-25(17-19-39)33(41)36-30-15-13-26(35)21-28(30)32(40)24-10-6-3-7-11-24/h2-15,20-21,25H,16-19H2,1H3,(H,36,41)