2-[[4-(5-chloranylpyrimidin-2-yl)piperazin-1-yl]methyl]-1-(phenylmethyl)benzimidazole

Systemtic Name: 2-[[4-(5-chloranylpyrimidin-2-yl)piperazin-1-yl]methyl]-1-(phenylmethyl)benzimidazole Openeye Name: 1-benzyl-2-[[4-(5-chloropyrimidin-2-yl)piperazin-1-yl]methyl]benzimidazole CAS Name: 2-[[4-(5-chloro-2-pyrimidinyl)-1-piperazinyl]methyl]-1-(phenylmethyl)benzimidazole IUPAC Name: 1-benzyl-2-[[4-(5-chloropyrimidin-2-yl)piperazin-1-yl]methyl]benzimidazole Traditional Name: 1-benzyl-2-[[4-(5-chloropyrimidin-2-yl)piperazino]methyl]benzimidazole Formula: C23H23ClN6 MolecularWeight: 418.92192

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=CC=CC=C3N2CC4=CC=CC=C4)C5=NC=C(C=N5)Cl

Isomeric SMILES

C1CN(CCN1CC2=NC3=CC=CC=C3N2CC4=CC=CC=C4)C5=NC=C(C=N5)Cl

InChI

InChI=1S/C23H23ClN6/c24-19-14-25-23(26-15-19)29-12-10-28(11-13-29)17-22-27-20-8-4-5-9-21(20)30(22)16-18-6-2-1-3-7-18/h1-9,14-15H,10-13,16-17H2