N2-phenyl-9-propan-2-yl-8-pyrazol-1-yl-purine-2,6-diamine

Systemtic Name: N2-phenyl-9-propan-2-yl-8-pyrazol-1-yl-purine-2,6-diamine Openeye Name: 9-isopropyl-N2-phenyl-8-pyrazol-1-yl-purine-2,6-diamine CAS Name: N2-phenyl-9-propan-2-yl-8-(1-pyrazolyl)purine-2,6-diamine IUPAC Name: 2-N-phenyl-9-propan-2-yl-8-pyrazol-1-ylpurine-2,6-diamine Traditional Name: (6-amino-9-isopropyl-8-pyrazol-1-yl-purin-2-yl)-phenyl-amine Formula: C17H18N8 MolecularWeight: 334.37842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C(=NC(=N2)NC3=CC=CC=C3)N)N=C1N4C=CC=N4

Isomeric SMILES

CC(C)N1C2=C(C(=NC(=N2)NC3=CC=CC=C3)N)N=C1N4C=CC=N4

InChI

InChI=1S/C17H18N8/c1-11(2)25-15-13(21-17(25)24-10-6-9-19-24)14(18)22-16(23-15)20-12-7-4-3-5-8-12/h3-11H,1-2H3,(H3,18,20,22,23)