4-[4-(3-chlorophenyl)piperazin-1-yl]-6-[4-(diphenylmethyl)piperazin-1-yl]-5-nitro-pyrimidine

Systemtic Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-6-[4-(diphenylmethyl)piperazin-1-yl]-5-nitro-pyrimidine Openeye Name: 4-(4-benzhydrylpiperazin-1-yl)-6-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitro-pyrimidine CAS Name: 4-[4-(3-chlorophenyl)-1-piperazinyl]-6-[4-(diphenylmethyl)-1-piperazinyl]-5-nitropyrimidine IUPAC Name: 4-(4-benzhydrylpiperazin-1-yl)-6-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitropyrimidine Traditional Name: 4-(4-benzhydrylpiperazino)-6-[4-(3-chlorophenyl)piperazino]-5-nitro-pyrimidine Formula: C31H32ClN7O2 MolecularWeight: 570.08448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=C(C(=NC=N3)N4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=C(C(=NC=N3)N4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6)[N+](=O)[O-]

InChI

InChI=1S/C31H32ClN7O2/c32-26-12-7-13-27(22-26)35-14-18-37(19-15-35)30-29(39(40)41)31(34-23-33-30)38-20-16-36(17-21-38)28(24-8-3-1-4-9-24)25-10-5-2-6-11-25/h1-13,22-23,28H,14-21H2