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

Systemtic Name: 4-[4-(diphenylmethyl)piperazin-1-yl]-6-imidazol-1-yl-5-nitro-pyrimidine Openeye Name: 4-(4-benzhydrylpiperazin-1-yl)-6-imidazol-1-yl-5-nitro-pyrimidine CAS Name: 4-[4-(diphenylmethyl)-1-piperazinyl]-6-(1-imidazolyl)-5-nitropyrimidine IUPAC Name: 4-(4-benzhydrylpiperazin-1-yl)-6-imidazol-1-yl-5-nitropyrimidine Traditional Name: 4-(4-benzhydrylpiperazino)-6-imidazol-1-yl-5-nitro-pyrimidine Formula: C24H23N7O2 MolecularWeight: 441.48512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=NC(=C2[N+](=O)[O-])N3C=CN=C3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=NC=NC(=C2[N+](=O)[O-])N3C=CN=C3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C24H23N7O2/c32-31(33)22-23(26-17-27-24(22)30-12-11-25-18-30)29-15-13-28(14-16-29)21(19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-12,17-18,21H,13-16H2