6-[(4-bromophenyl)methyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine

Systemtic Name: 6-[(4-bromophenyl)methyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine Openeye Name: 6-[(4-bromophenyl)methyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine CAS Name: 6-[(4-bromophenyl)methyl]-2-[4-(2-pyrimidinyl)-1-piperazinyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine IUPAC Name: 6-[(4-bromophenyl)methyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine Traditional Name: 6-(4-bromobenzyl)-2-[4-(2-pyrimidyl)piperazino]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine Formula: C22H24BrN7 MolecularWeight: 466.37686

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CN=C(N=C21)N3CCN(CC3)C4=NC=CC=N4)CC5=CC=C(C=C5)Br

Isomeric SMILES

C1CN(CC2=CN=C(N=C21)N3CCN(CC3)C4=NC=CC=N4)CC5=CC=C(C=C5)Br

InChI

InChI=1S/C22H24BrN7/c23-19-4-2-17(3-5-19)15-28-9-6-20-18(16-28)14-26-22(27-20)30-12-10-29(11-13-30)21-24-7-1-8-25-21/h1-5,7-8,14H,6,9-13,15-16H2