6-[6-[5-(3-cyanophenyl)-1H-pyrazol-4-yl]benzimidazol-1-yl]pyridine-3-carbonitrile trihydrochloride

Systemtic Name: 6-[6-[5-(3-cyanophenyl)-1H-pyrazol-4-yl]benzimidazol-1-yl]pyridine-3-carbonitrile trihydrochloride Openeye Name: 6-[6-[5-(3-cyanophenyl)-1H-pyrazol-4-yl]benzimidazol-1-yl]pyridine-3-carbonitrile trihydrochloride CAS Name: 6-[6-[5-(3-cyanophenyl)-1H-pyrazol-4-yl]-1-benzimidazolyl]-3-pyridinecarbonitrile trihydrochloride IUPAC Name: 6-[6-[5-(3-cyanophenyl)-1H-pyrazol-4-yl]benzimidazol-1-yl]pyridine-3-carbonitrile trihydrochloride Traditional Name: 6-[6-[5-(3-cyanophenyl)-1H-pyrazol-4-yl]benzimidazol-1-yl]nicotinonitrile trihydrochloride Formula: C23H16Cl3N7 MolecularWeight: 496.77904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C2=C(C=NN2)C3=CC4=C(C=C3)N=CN4C5=NC=C(C=C5)C#N)C#N.Cl.Cl.Cl

Isomeric SMILES

C1=CC(=CC(=C1)C2=C(C=NN2)C3=CC4=C(C=C3)N=CN4C5=NC=C(C=C5)C#N)C#N.Cl.Cl.Cl

InChI

InChI=1S/C23H13N7.3ClH/c24-10-15-2-1-3-18(8-15)23-19(13-28-29-23)17-5-6-20-21(9-17)30(14-27-20)22-7-4-16(11-25)12-26-22;;;/h1-9,12-14H,(H,28,29);3*1H