1-[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]piperazine trihydrochloride

Systemtic Name: 1-[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]piperazine trihydrochloride Openeye Name: 1-[5-(4-chlorophenyl)-4-(4-pyridyl)-1H-pyrazol-3-yl]piperazine trihydrochloride CAS Name: 1-[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]piperazine trihydrochloride IUPAC Name: 1-[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]piperazine trihydrochloride Traditional Name: 1-[5-(4-chlorophenyl)-4-(4-pyridyl)-1H-pyrazol-3-yl]piperazine trihydrochloride Formula: C18H21Cl4N5 MolecularWeight: 449.20484

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NNC(=C2C3=CC=NC=C3)C4=CC=C(C=C4)Cl.Cl.Cl.Cl

Isomeric SMILES

C1CN(CCN1)C2=NNC(=C2C3=CC=NC=C3)C4=CC=C(C=C4)Cl.Cl.Cl.Cl

InChI

InChI=1S/C18H18ClN5.3ClH/c19-15-3-1-14(2-4-15)17-16(13-5-7-20-8-6-13)18(23-22-17)24-11-9-21-10-12-24;;;/h1-8,21H,9-12H2,(H,22,23);3*1H