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9-phenethyl-N2-(phenylmethyl)-8-pyrazol-1-yl-purine-2,6-diamine

9-phenethyl-N2-(phenylmethyl)-8-pyrazol-1-yl-purine-2,6-diamine

Systemtic Name:9-phenethyl-N2-(phenylmethyl)-8-pyrazol-1-yl-purine-2,6-diamine
Openeye Name:N2-benzyl-9-phenethyl-8-pyrazol-1-yl-purine-2,6-diamine
CAS Name:9-phenethyl-N2-(phenylmethyl)-8-(1-pyrazolyl)purine-2,6-diamine
IUPAC Name:2-N-benzyl-9-phenethyl-8-pyrazol-1-ylpurine-2,6-diamine
Traditional Name:(6-amino-9-phenethyl-8-pyrazol-1-yl-purin-2-yl)-benzyl-amine
Formula: C23H22N8
MolecularWeight: 410.47438
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C3=C(C(=NC(=N3)NCC4=CC=CC=C4)N)N=C2N5C=CC=N5


Isomeric SMILES

C1=CC=C(C=C1)CCN2C3=C(C(=NC(=N3)NCC4=CC=CC=C4)N)N=C2N5C=CC=N5


InChI

InChI=1S/C23H22N8/c24-20-19-21(29-22(28-20)25-16-18-10-5-2-6-11-18)30(15-12-17-8-3-1-4-9-17)23(27-19)31-14-7-13-26-31/h1-11,13-14H,12,15-16H2,(H3,24,25,28,29)


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