N-(2-bromophenyl)-4-[6-methyl-2-(4-methylphenyl)-5-(phenylmethyl)pyrimidin-4-yl]piperazine-1-carboxamide

Systemtic Name: N-(2-bromophenyl)-4-[6-methyl-2-(4-methylphenyl)-5-(phenylmethyl)pyrimidin-4-yl]piperazine-1-carboxamide Openeye Name: 4-[5-benzyl-6-methyl-2-(p-tolyl)pyrimidin-4-yl]-N-(2-bromophenyl)piperazine-1-carboxamide CAS Name: N-(2-bromophenyl)-4-[6-methyl-2-(4-methylphenyl)-5-(phenylmethyl)-4-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: 4-[5-benzyl-6-methyl-2-(4-methylphenyl)pyrimidin-4-yl]-N-(2-bromophenyl)piperazine-1-carboxamide Traditional Name: 4-[5-benzyl-6-methyl-2-(p-tolyl)pyrimidin-4-yl]-N-(2-bromophenyl)piperazine-1-carboxamide Formula: C30H30BrN5O MolecularWeight: 556.4961

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C(=N2)N3CCN(CC3)C(=O)NC4=CC=CC=C4Br)CC5=CC=CC=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C(=N2)N3CCN(CC3)C(=O)NC4=CC=CC=C4Br)CC5=CC=CC=C5)C

InChI

InChI=1S/C30H30BrN5O/c1-21-12-14-24(15-13-21)28-32-22(2)25(20-23-8-4-3-5-9-23)29(34-28)35-16-18-36(19-17-35)30(37)33-27-11-7-6-10-26(27)31/h3-15H,16-20H2,1-2H3,(H,33,37)