[9-(phenylmethyl)-8-pyrazol-1-yl-purin-6-yl]methanamine

Systemtic Name: [9-(phenylmethyl)-8-pyrazol-1-yl-purin-6-yl]methanamine Openeye Name: (9-benzyl-8-pyrazol-1-yl-purin-6-yl)methanamine CAS Name: [9-(phenylmethyl)-8-(1-pyrazolyl)-6-purinyl]methanamine IUPAC Name: (9-benzyl-8-pyrazol-1-ylpurin-6-yl)methanamine Traditional Name: (9-benzyl-8-pyrazol-1-yl-purin-6-yl)methylamine Formula: C16H15N7 MolecularWeight: 305.3372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=NC=NC(=C3N=C2N4C=CC=N4)CN

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=NC=NC(=C3N=C2N4C=CC=N4)CN

InChI

InChI=1S/C16H15N7/c17-9-13-14-15(19-11-18-13)22(10-12-5-2-1-3-6-12)16(21-14)23-8-4-7-20-23/h1-8,11H,9-10,17H2