3-(1H-benzimidazol-2-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-(1H-benzimidazol-2-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 3-(1H-benzimidazol-2-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one CAS Name: 3-(1H-benzimidazol-2-yl)-1-[4-(2-pyrimidinyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(1H-benzimidazol-2-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 3-(1H-benzimidazol-2-yl)-1-[4-(2-pyrimidyl)piperazino]propan-1-one Formula: C18H20N6O MolecularWeight: 336.391

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)CCC3=NC4=CC=CC=C4N3

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)CCC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C18H20N6O/c25-17(7-6-16-21-14-4-1-2-5-15(14)22-16)23-10-12-24(13-11-23)18-19-8-3-9-20-18/h1-5,8-9H,6-7,10-13H2,(H,21,22)