3-(4-chlorophenyl)-1-(1H-pyrazol-4-yl)-2H-purine

Systemtic Name: 3-(4-chlorophenyl)-1-(1H-pyrazol-4-yl)-2H-purine Openeye Name: 3-(4-chlorophenyl)-1-(1H-pyrazol-4-yl)-2H-purine CAS Name: 3-(4-chlorophenyl)-1-(1H-pyrazol-4-yl)-2H-purine IUPAC Name: 3-(4-chlorophenyl)-1-(1H-pyrazol-4-yl)-2H-purine Traditional Name: 3-(4-chlorophenyl)-1-(1H-pyrazol-4-yl)-2H-purine Formula: C14H11ClN6 MolecularWeight: 298.73034

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Descriptors Computed from Structure

Canonical SMILES:

C1N(C=C2C(=NC=N2)N1C3=CC=C(C=C3)Cl)C4=CNN=C4

Isomeric SMILES

C1N(C=C2C(=NC=N2)N1C3=CC=C(C=C3)Cl)C4=CNN=C4

InChI

InChI=1S/C14H11ClN6/c15-10-1-3-11(4-2-10)21-9-20(12-5-18-19-6-12)7-13-14(21)17-8-16-13/h1-8H,9H2,(H,18,19)