1-[6-[4-(diphenylmethyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]benzimidazole

Systemtic Name: 1-[6-[4-(diphenylmethyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]benzimidazole Openeye Name: 1-[6-(4-benzhydrylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]benzimidazole CAS Name: 1-[6-[4-(diphenylmethyl)-1-piperazinyl]-5-nitro-4-pyrimidinyl]benzimidazole IUPAC Name: 1-[6-(4-benzhydrylpiperazin-1-yl)-5-nitropyrimidin-4-yl]benzimidazole Traditional Name: 1-[6-(4-benzhydrylpiperazino)-5-nitro-pyrimidin-4-yl]benzimidazole Formula: C28H25N7O2 MolecularWeight: 491.5438

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=NC(=C2[N+](=O)[O-])N3C=NC4=CC=CC=C43)C(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1C2=NC=NC(=C2[N+](=O)[O-])N3C=NC4=CC=CC=C43)C(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C28H25N7O2/c36-35(37)26-27(29-19-30-28(26)34-20-31-23-13-7-8-14-24(23)34)33-17-15-32(16-18-33)25(21-9-3-1-4-10-21)22-11-5-2-6-12-22/h1-14,19-20,25H,15-18H2